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e,"NEW");break;case 106:Z(b,ey);Y(b,f+7,e+7,f+a.V-7,e+a.V-7);Y(b,f+8,e+7,f+a.V-6,e+a.V-7);Y(b,f+7,e+a.V-7,f+a.V-7,e+7);Y(b,f+8,e+a.V-7,f+a.V-6,e+7);Z(b,dy);Y(b,f+c,e+~~(a.V/2),f+12,e+~~(a.V/2));yE(a,b,f+6,e,uc);break;case 104:Z(b,ey);Y(b,f+7,e+7,f+a.V-7,e+a.V-7);Y(b,f+8,e+7,f+a.V-6,e+a.V-7);Y(b,f+7,e+a.V-7,f+a.V-7,e+7);Y(b,f+8,e+a.V-7,f+a.V-6,e+7);Z(b,dy);break;case 105:a.xb?(Z(b,iy),Y(b,f+11,e+5,f+9,e+9),Y(b,f+9,e+9,f+4,e+9),Y(b,f+4,e+9,f+8,e+12),Y(b,f+8,e+12,f+6,e+18),Y(b,f+6,e+18,f+11,e+15),Y(b,
f+12,e+5,f+14,e+9),Y(b,f+14,e+9,f+19,e+9),Y(b,f+19,e+9,f+15,e+12),Y(b,f+15,e+12,f+17,e+18),Y(b,f+17,e+18,f+12,e+15),Z(b,dy)):yE(a,b,f,e,"123");break;case 113:Z(b,jy);Ny(b,f+4,e+4,a.V-8,a.V-8);Z(b,dy);IC(b,f+4,e+4,a.V-8,a.V-8);AE(a,b,f+1,e-1,Zx,"i");break;case 201:Y(b,f+c,e+~~(a.V/2),f+a.V-c,e+~~(a.V/2)+2);Y(b,f+c,e+~~(a.V/2),f+a.V-c,e+~~(a.V/2)-2);Y(b,f+a.V-c,e+~~(a.V/2)+2,f+a.V-c,e+~~(a.V/2)-2);break;case 202:Y(b,f+c,e+~~(a.V/2),f+a.V-c,e+~~(a.V/2));break;case 203:Y(b,f+c,e+~~(a.V/2)-2,f+a.V-c,e+
~~(a.V/2)-2);Y(b,f+c,e+~~(a.V/2)+2,f+a.V-c,e+~~(a.V/2)+2);break;case 204:Y(b,f+c,e+~~(a.V/2),f+a.V-c,e+~~(a.V/2));Y(b,f+c,e+~~(a.V/2)-2,f+a.V-c,e+~~(a.V/2)-2);Y(b,f+c,e+~~(a.V/2)+2,f+a.V-c,e+~~(a.V/2)+2);break;case 205:Y(b,f+~~(c/2),e+2*c+~~(c/3),f+3*~~(c/2),e+2*c-~~(c/3));a=ub+(f+3*~~(c/2))+ka+(e+2*c-~~(c/3))+ja+(f+5*~~(c/2))+la+(e+2*c+~~(c/3))+ia+b.d+ga+b.a+cb;DC(b,a);e=ub+(f+5*~~(c/2))+ka+(e+2*c+~~(c/3))+ja+(f+7*~~(c/2))+la+(e+2*c-~~(c/3))+ia+b.d+ga+b.a+cb;DC(b,e);break;case 206:BE(a,b,f,e+2,3);
break;case 207:BE(a,b,f,e,4);break;case 208:BE(a,b,f,e,5);break;case 209:BE(a,b,f,e,1);break;case 210:BE(a,b,f,e,6);break;case 211:BE(a,b,f,e,7);break;case 212:BE(a,b,f,e,8);break;case 213:yE(a,b,f,e,"FG"),a.C=new bz(f,e)}else d=3,301==g?d=3:401==g?d=4:501==g?d=5:601==g?d=8:701==g?d=9:801==g?d=10:901==g?d=11:1001==g?d=12:1101==g?d=7:1201==g?d=18:1301==g&&(d=19),null!=EA[d]&&AE(a,b,f,e,DA[d],EA[d])}
function CE(a){var b,c,d;a.eb&&(d=a.F.a,c=a.y.b-a.V,b=a.V,Z(d,MA),Ny(d,0,0,c,b),a.ib?(Z(d,(Yx(),cy)),IC(d,-1,0,c,b-1)):(Z(d,oE),Y(d,0,0,c-1-2,0),Z(d,ly(MA)),Y(d,0,b-1,c-1,b-1),Y(d,c-1,0,c-1,b-1)),KC(d,a.T),Z(d,(Yx(),dy)),0==a.G.indexOf("E")&&Z(d,ey),JC(d,a.G,10,15),$B(a.Db,a.F,a.V,a.y.a-a.V))}
function DE(a){var b,c,d,e;if(a.fb){d=a.M.a;c=a.V;b=a.y.a-2*a.V-a.O;Z(d,MA);Ny(d,0,0,c,b);a.ib?(Z(d,(Yx(),cy)),Y(d,0,b-1,c,b-1),e=yA*(a.V+a.O)+2,Y(d,0,e,c,e),Y(d,0,e,0,b),Y(d,a.V-1,e,a.V-1,b-a.V)):(Z(d,oE),Y(d,0,0,0,b-1),Y(d,0,yA*a.V,b-1,yA*a.V),Z(d,ly(MA)),Y(d,c-1,0,c-1,b-1-a.V),Y(d,0,b-1,c-1,b-1));for(b=3;b<=yA+2;++b)xE(a,d,1,b);$B(a.Db,a.M,0,2*a.V+a.O)}}
function EE(a){var b,c,d,e;if(a.gb){e=a._.a;c=a.y.b-a.V;b=a.y.a-3*a.V-a.O;Z(e,a.r);Ny(e,0,0,c,b);for(d=1;d<=a.mb;++d){var f=a.ab[d],g=e,h=void 0,i=void 0,l=void 0,m=void 0,n=void 0,o=l=void 0,q=void 0,w=void 0,G=w=n=m=void 0,z=o=void 0,K=m=q=n=h=void 0,O=m=h=void 0,S=i=n=i=void 0,ca=w=z=void 0,N=ca=q=o=l=z=m=q=G=K=o=void 0,N=i=o=n=n=K=N=S=h=O=O=G=S=o=o=O=S=void 0,w=z=1,l=2,ca=3;f.v&&(uE(f),tE(f.k,1,f.k.mb,0),f.v=!1);1!=f.k.x&&(l*=f.k.x,ca*=f.k.x,h=1,0.7>f.k.x&&(h=1.2),h=H(f.k.A*f.k.x*h),f.k.j=new Ay(Zb,
0,h),f.k.k=null);f.k.w&&(Z(g,(Yx(),dy)),IC(g,0,0,f.k.y.b-1,f.k.y.a-1));if(0!=f.s){if(-1==f.j){m=J(I(Math.round(12*l)));for(h=1;h<=f.s;++h)0<f.b[h]&&7>f.b[h]&&(Z(g,(mE(),qE)[f.b[h]]),i=g,n=H(f.I[h]-m/2),O=H(f.L[h]-m/2),S=N=m,FC(i,!0),DC(i,GC(i,n,O,N,S)));for(h=1;h<=f.t;++h)i=f.G[h],m=f.H[h],0!=f.b[i]&&f.b[i]==f.b[m]&&(Z(g,(mE(),qE)[f.b[i]]),o=f.I[m]-f.I[i],z=f.L[m]-f.L[i],w=Math.sqrt(o*o+z*z),1>w&&(w=1),z/=w,w=o/w,q=3*ca*z,o=3*ca*w,O=v(F,r,-1,4,1),n=v(F,r,-1,4,1),O[0]=H(f.I[i]+q),n[0]=H(f.L[i]-o),
O[1]=H(f.I[m]+q),n[1]=H(f.L[m]-o),O[2]=H(f.I[m]-q),n[2]=H(f.L[m]+o),O[3]=H(f.I[i]-q),n[3]=H(f.L[i]+o),m=g,i=O,FC(m,!0),DC(m,NC(m,i,n,4,!0)))}for(h=1;h<=f.t;++h){Z(g,(Yx(),dy));i=f.G[h];m=f.H[h];1==f.j&&0!=f.b[i]&&f.b[i]==f.b[m]&&Z(g,(mE(),qE)[f.b[i]]);if(3==f.A[h]||4==f.A[h])n=i,i=m,m=n;S=f.I[i];N=f.L[i];O=f.I[m];n=f.L[m];if(1!=f.r[h]||0!=f.A[h])o=O-S,z=n-N,w=Math.sqrt(o*o+z*z),1>w&&(w=1),z/=w,w=o/w;switch(f.r[h]){case 2:10<=f.A[h]&&Z(g,hy);q=l*z;o=l*w;Y(g,J(I(Math.round(S+q))),J(I(Math.round(N-o))),
J(I(Math.round(O+q))),J(I(Math.round(n-o))));Y(g,J(I(Math.round(S-q))),J(I(Math.round(N+o))),J(I(Math.round(O-q))),J(I(Math.round(n+o))));Z(g,dy);break;case 3:m=J(I(Math.round(S)));i=J(I(Math.round(N)));O=J(I(Math.round(O)));n=J(I(Math.round(n)));Y(g,m,i,O,n);S=J(I(Math.round(ca*z)));N=J(I(Math.round(ca*w)));Y(g,m+S,i-N,O+S,n-N);Y(g,m-S,i+N,O-S,n+N);break;case 9:case 0:for(i=0;10>i;++i)G=S-(S-O)/10*i,K=N-(N-n)/10*i,Y(g,J(I(Math.round(G))),J(I(Math.round(K))),J(I(Math.round(G))),J(I(Math.round(K))));
KC(g,f.k.j);m=Cy(f.k.k.c).a;o=f.e[h];i=xb;null!=o&&(i=o);o=lz(f.k.k,i);S=J(I(Math.round((S+O)/2-o/2)));o=J(I(Math.round((N+n)/2+~~(m/2)-1)));Z(g,hy);JC(g,i,S,o);Z(g,dy);break;default:if(1==f.A[h]||3==f.A[h])q=ca*z,o=ca*w,K=v(F,r,-1,3,1),G=v(F,r,-1,3,1),K[0]=J(I(Math.round(O+q))),G[0]=J(I(Math.round(n-o))),K[1]=J(I(Math.round(S))),G[1]=J(I(Math.round(N))),K[2]=J(I(Math.round(O-q))),G[2]=J(I(Math.round(n+o))),m=g,i=K,n=G,FC(m,!0),DC(m,NC(m,i,n,3,!0));else if(2==f.A[h]||4==f.A[h]){q=ca*z;o=ca*w;for(i=
0;10>i;++i)G=S-(S-O)/10*i,K=N-(N-n)/10*i,m=i/10,Y(g,J(I(Math.round(G+q*m))),J(I(Math.round(K-o*m))),J(I(Math.round(G-q*m))),J(I(Math.round(K+o*m))))}else Y(g,J(I(Math.round(S))),J(I(Math.round(N))),J(I(Math.round(O))),J(I(Math.round(n))))}}w=v(mC,k,-1,f.s+1,1);z=v(F,r,-1,f.s+1,1);for(h=1;h<=f.t;++h)i=f.G[h],m=f.H[h],l=f.I[i],n=f.I[m],++z[i],++z[m],w[i]=w[i]/z[i]+n/z[i],w[m]=w[m]/z[m]+l/z[m];KC(g,f.k.j);m=Cy(f.k.k.c).a;N=v(Fq,k,1,f.s+1,0);O=v(F,r,-1,f.s+1,1);n=v(F,r,-1,f.s+1,1);l=v(FE,k,49,f.s+1,0);
for(h=1;h<=f.s;++h)i=GE(f,h),(null==i||1>i.length)&&(i=Aa),3==f.c[h]&&0<f.y[h]&&0==f.z[h]?(N[h]=i,O[h]=n[h]=lz(f.k.k,i),l[h]=HE(f,h,O[h],O[h],m,!1)):(S=w[h]<f.I[h],G=!0,1<z[h]&&(0>=w[h]-f.I[h]?0-(w[h]-f.I[h]):w[h]-f.I[h])<25*f.k.x/3&&(G=!1),2<z[h]&&(G=!1),1==z[h]&&(0>=w[h]-f.I[h]?0-(w[h]-f.I[h]):w[h]-f.I[h])<25*f.k.x/10&&(S=!0),o=i,K=j,f.k.vb&&0<f.w[h]&&(K+=Yb,1<f.w[h]&&(K+=f.w[h])),q=j,0!=f.z[h]&&(1<Si(f.z[h])&&(q+=Si(f.z[h])),0<f.z[h]?q+=Ba:q+=Ea),S||!G?i=i+K+q+j:i=q+K+j+i,G||(o=i),N[h]=i,o=lz(f.k.k,
o),q=lz(f.k.k,i),O[h]=o,n[h]=q,q=l[h]=HE(f,h,o,q,m,S),S=q.c+1+1,o=q.d+m,Z(g,f.k.r),-1==f.j&&0!=f.b[h]&&Z(g,(mE(),qE)[f.b[h]]),Ny(g,q.c,q.d,q.b,q.a),1==f.j?0!=f.b[h]?Z(g,(mE(),qE)[f.b[h]]):Z(g,(Yx(),dy)):Z(g,(mE(),DA)[f.c[h]]),JC(g,i,S,o));for(i=1;i<=f.x;++i)h=f.p[i][0],o=O[h],q=n[h],S=J(I(vB(f.I[h]-o/2))),o=J(I(vB(f.L[h]+~~(m/2)-1))),Z(g,(Yx(),hy)),JC(g,ea+f.p[i][1],S+q,o);if(0<f.C||0<f.D)if(Z(g,104==f.k.b?(Yx(),ey):(Yx(),jy)),0<f.C&&106!=f.k.b&&(q=l[f.C],IC(g,q.c,q.d,q.b,q.a)),0<f.D&&(i=f.G[f.D],
m=f.H[f.D],o=f.I[m]-f.I[i],z=f.L[m]-f.L[i],w=Math.sqrt(o*o+z*z),1>w&&(w=1),z/=w,w=o/w,q=(ca+1)*z,o=(ca+1)*w,K=v(F,r,-1,5,1),G=v(F,r,-1,5,1),K[0]=J(I(vB(f.I[i]+q))),K[1]=J(I(vB(f.I[m]+q))),G[0]=J(I(vB(f.L[i]-o))),G[1]=J(I(vB(f.L[m]-o))),K[3]=J(I(vB(f.I[i]-q))),K[2]=J(I(vB(f.I[m]-q))),G[3]=J(I(vB(f.L[i]+o))),G[2]=J(I(vB(f.L[m]+o))),K[4]=K[0],G[4]=G[0],106!=f.k.b&&(ca=g,h=K,z=G,FC(ca,!1),DC(ca,NC(ca,h,z,5,!0))),106==f.k.b&&IE(f,f.G[f.D],f.H[f.D]))){ca=0;for(h=1;h<=f.s;++h)0<f.a[h]&&++ca;if(ca>~~(f.s/
2))for(h=1;h<=f.s;++h)0<f.a[h]?f.a[h]=0:f.a[h]=1;Z(g,(Yx(),ey));for(h=1;h<=f.s;++h)0<f.a[h]&&(q=l[h],IC(g,q.c,q.d,q.b,q.a))}}}a.v||(a.ib?(Z(e,(Yx(),cy)),Y(e,c-1,0,c-1,b-1)):(Z(e,ly(MA)),Y(e,c-1,0,c-1,b-1),Z(e,MA),Y(e,c-2,0,c-2,b-1),Z(e,oE),Y(e,c-3,0,c-3,b-1)));a.rb&&(d=~~((c-48)/2),Z(e,(Yx(),hy)),Y(e,d,~~(b/2),d+48,~~(b/2)),Y(e,d+48,~~(b/2),d+48-6,~~(b/2)+6),Y(e,d+48,~~(b/2),d+48-6,~~(b/2)-6));a.v&&(a.P=new Ay(Zb,0,a.A),a.S=new kz(a.P),null!=a.$&&(d=lz(a.S,a.$),c=J(I(Math.round((c-d)/2))),b-=a.A,
Z(e,(Yx(),dy)),KC(e,a.P),JC(e,a.$,c,b)));$B(a.Db,a._,a.V,2*a.V+a.O)}}
function BE(a,b,c,d,e){var f,g,h,i,l;f=~~(a.V/4);g=!1;i=v(F,r,-1,9,1);l=v(F,r,-1,9,1);c+=~~(a.V/2);d+=~~(a.V/2);a=~~(a.V/2)-~~(f/2);1==e&&(e=6,g=!0);for(f=0;f<=e;++f)h=6.283185307179586/e*(f-0.5),i[f]=H(c+a*Math.sin(h)),l[f]=H(d+a*Math.cos(h));f=e+1;FC(b,!1);DC(b,NC(b,i,l,f,2<f));if(g){for(f=0;f<=e;++f)h=6.283185307179586/e*(f-0.5),i[f]=H(c+(a-3)*Math.sin(h)),l[f]=H(d+(a-3)*Math.cos(h));Y(b,i[0],l[0],i[1],l[1]);Y(b,i[2],l[2],i[3],l[3]);Y(b,i[4],l[4],i[5],l[5])}}
function JE(a){var b,c,d;if(a.hb){d=a.Ab.a;b=a.y.b;c=2*a.V+a.O;Z(d,MA);Ny(d,0,0,b,c);a.ib?(Z(d,(Yx(),cy)),c=13*(a.V+a.O),IC(d,c,0,b-c-1,2*a.V+a.O-1)):(Z(d,ly(MA)),Y(d,b-1,0,b-1,c-1),Y(d,0,c-1,b-1-2,c-1),Z(d,oE),Y(d,0,0,b-1,0));c=a.b;233<=a.b&&262>=a.b&&(a.b=213);for(b=1;13>=b;++b)xE(a,d,b,1),xE(a,d,b,2);a.b=c;$B(a.Db,a.Ab,0,0)}}
function zE(a,b,c,d,e){var f,g,h,i,l,m,n,o;l=~~(d/4);m=2+~~(l/2);g=2+l;o=c+~~(10*d/24);i=o+l;n=b+d;e?(h=2+b,f=m+b,g+=b):(f=n-m,h=n-2,g=n-g);Y(a,h,o,f,i);Y(a,g,o,f,i);h=~~(l/3);Y(a,f,o+h,f,i);f=d-m-4;i=270;e?(b+=m,e=270):(b=n-f-m,i*=-1,e=-90);EC(a,b,c+m-h,f,d-4-h-1,e,i)}
function KE(a,b){var c,d,e,f,g,h,i;QA(a);if(0==b.indexOf("$RXN")){a.rb=!0;a.db=!0;g=LE(b);i=new pA(b,g,!0);d=j;for(c=1;5>=c;++c)d=ME(i,g);c=rB(Xz(dn(d.substr(0,3)),10)).a;f=rB(Xz(dn(d.substr(3,3)),10)).a;ME(i,g);for(d=1;d<=c+f;++d){for(e=j;!(h=ME(i,g),null==h||C(h,"$MOL"));)e+=h+g;a.ab[++a.mb]=new NE(a,e)}tE(a,1,c,1);tE(a,c+1,c+f,3)}else{a.rb=!1;a.W=new NE(a,b);if(!a.W||0==a.W.s)return a.eb=!0,a.G="ERROR - problems in reading/processing MOL input",BA(a),!1;null!=a.f&&a.W&&HA(a.W,a.f,!0);null!=a.i&&
a.W&&HA(a.W,a.i,!1);g=OE(a.W,!1);if(1==g)a.ab[++a.mb]=a.W;else{a.db=!0;for(d=1;d<=g;++d)a.ab[++a.mb]=new PE(a,a.W,d)}a.d=1;a.W=a.ab[a.d];tE(a,1,g,0)}BA(a);return!0}
function QE(a,b){var c,d,e,f,g,h,i,l;QA(a);c=f=0;l=new pA(b,"|>",!0);e=-1<b.indexOf(wb);h=1;g=iA(l);a.mb=0;for(d=1;d<=g;++d)if(i=mA(l),dn(i),!C(i,Ng))if(C(i,wb))++h,2==h?f=a.mb:3==h&&(c=a.mb+1);else{a.W=new SA(a,i);if(0==a.W.s)return a.eb=!0,a.G="ERROR - problems in reading/processing molecule !",Jz(),!1;++a.mb;a.d=a.mb;a.ab[a.mb]=a.W}if(2==h)return a.eb=!0,a.G="ERROR - strange reaction - fixing !",Jz(),!1;if(3<h)return a.eb=!0,a.G="ERROR - strange reaction !",Jz(),!1;1<a.mb&&!e&&AA(a,pf);e&&!a.rb&&
AA(a,Pf);!e&&a.rb&&AA(a,tf);e?(tE(a,1,f,1),tE(a,f+1,c-1,2),tE(a,c,a.mb,3)):tE(a,1,a.mb,0);BA(a);return!0}function rp(a,b){a.eb=!0;a.G=b}
function vp(a,b){var c,d;if(0!=b){oC(a);c=a.b;a.b=b;if(300>=b)switch(a.hb=!0,a.fb=!0,b){case 102:vE(a);d=a.X;d.a=d.b;d.b.c=null;break;case 110:a.gb=!0;a.b=c;a.X.a!=a.X.b&&a.X.a.b!=a.X.b?a.e&&(++a.mb,a.d=a.mb,a.e=!1):(a.eb=!0,a.G="No more undo");if(!(a.X.a!=a.X.b&&a.X.a.b!=a.X.b))break;d=a.X;if(!(d.a!=d.b&&d.a.b!=d.b))throw new kt("Cannot undo. Index is out of range.");if(!d.a.b)throw new kt(dc);d.a=d.a.b;RE(a,d.a.a);a.gb=!0;break;case 111:a.b=c;if(a.X.a.c)a.e&&(++a.mb,a.d=a.mb,a.e=!1);else{a.eb=!0;
a.G="No more redo";break}if(!a.X.a.c)break;d=a.X;if(!d.a.c)throw new kt("Cannot redo. Index is out of range.");if(!d.a.c)throw new kt(dc);d.a=d.a.c;RE(a,d.a.a);a.gb=!0;break;case 152:a.b=c;d=a.tb;0<d.a?(--d.a,d=bs(d,d.a)):d=null;null==d?(a.eb=!0,a.G=lc):(rp(a,hc+(a.tb.a+1)),d=xB(d),IA(a,d,!1));break;case 151:d=a.tb;d.a<d.c-1?(++d.a,d=bs(d,d.a)):d=null;null==d?(a.eb=!0,a.G=lc):(rp(a,hc+(a.tb.a+1)),d=xB(d),IA(a,d,!1));break;case 101:a.wb&&hE(a.wb);a.wb=new SE(1,a);a.b=c;break;case 107:!a.pb?a.pb=new TE(a):
a.pb.Rb.c.$?LD(a.pb.Rb.c):KA(a.pb);break;case 113:a.a&&hE(a.a);a.a=new SE(0,a);a.b=c;break;case 103:a.gb=!0;a.jb=!0;a.b=c;break;case 105:a.gb=!0;a.p&&a.bb&&(a.bb=!1,CA(a.W),a.b=c);a.u=1;break;case 112:Jz();case 109:a.b=c;d=UE(a.W);if(2==d){a.eb=!0;a.G="Copying the agent not possible !";break}d=v(mC,k,-1,4,1);nC(a.W,d);a.gb=!0;a.W=new sE(a.W);d=H(~~((a.y.b-a.V)/2)-d[0]);for(c=1;c<=a.W.s;++c)a.W.I[c]+=2*d;TA(a.W);a.ab[++a.mb]=a.W;a.d=a.mb;break;case 104:0<a.W.C?(a.gb=!0,jC(a.W,a.W.C),a.W.C=0,qC(a)):
0<a.W.D&&(a.gb=!0,kC(a.W,a.W.D),a.W.D=0,qC(a));sC(a.W);break;case 213:a.b=c;if(!a.B){var e,f,g,h;h=new gz;for(d=a.D,e=0,f=d.length;e<f;++e)c=d[e],g=new Zy(c),ez(h,g),g.c=c,vx(g.d,a);vw(a,h);a.B=h}fz(a.B,a,a.C.a,a.C.b)}else{a.fb=!0;a.hb=!0;switch(b){case 301:a.c=3;break;case 401:a.c=4;break;case 501:a.c=5;break;case 701:a.c=9;break;case 801:a.c=10;break;case 901:a.c=11;break;case 1001:a.c=12;break;case 601:a.c=8;break;case 1101:a.c=7;break;case 1300:a.c=1;break;case 1201:a.n&&(hE(a.n),a.n=null);0==
a.W.C&&(a.n=new SE(2,a));a.c=18;break;case 1301:a.c=19;break;case 1302:a.c=20;break;case 1303:a.c=21;break;case 1304:a.c=22}0<a.W.C&&(a.gb=!0,a.c!=a.W.c[a.W.C]&&18!=a.c&&(a.W.c[a.W.C]=a.c,a.W.z[a.W.C]=0,a.W.w[a.W.C]=0,qC(a)),18==a.c&&(d=kn((sp(),tp).Rb.a.gb,Eg),VE(a.W,a.W.C,d),qC(a)),sC(a.W))}BA(a)}}
function op(a){var b,c,d;d=UA(a);c=j;if(a.rb){var e,f,g;g=uq([4,a.mb+1]);for(f=1;3>=f;++f){e=0;for(b=1;b<=a.mb;++b)UE(a.ab[b])==f&&(g[f][++e]=b);g[f][0]=e}c=c+"$RXN\n\n\nJME Molecular Editor\n"+(WE(g[1][0],3)+WE(g[3][0],3)+ba);for(b=1;b<=g[1][0];++b)c+=pa+XE(a.ab[g[1][b]],d);for(b=1;b<=g[3][0];++b)c+=pa+XE(a.ab[g[3][b]],d)}else 1<a.mb&&(a.W=new YE(a,a.ab,a.mb)),c=XE(a.W,d),1<a.mb&&(a.W=a.ab[a.d]);return c}
function gC(a,b,c,d){var e;e=c;var f=d,g,h;h=hC(b);g=0!=(b.e&2);h||g?(a.rb?fz((!a.t&&(a.t=xA(a,!0)),a.t),a,e,f):fz((!a.s&&(a.s=xA(a,!1)),a.s),a,e,f),e=!0):e=!1;if(!e&&!a.v)if(a.eb=!1,a.Bb=c-a.V,a.Cb=d-(2*a.V+a.O),a.eb=!0,a.G=j,a.bb=lC(b),a.cb=!1,c<a.V||d<2*a.V+a.O){e=0;for(b=1;13>=b;++b)if(c<b*(a.V+a.O)){e=b;break}c=0;for(b=1;b<=yA+2;++b)if(d<b*(a.V+a.O)){c=b;break}0==e||0==c||(d=100*c+e,112==d||!a.ob&&107==d||!a.yb&&201==d||!a.db&&103==d||!a.lb&&!a.p&&105==d||!a.rb&&109==d||vp(a,d))}else if(!(d>
a.y.a-a.V-1)){a.cb=!0;c-=a.V;d-=2*a.V+a.O;if(0<a.W.C)if(104==a.b)jC(a.W,a.W.C),a.W.C=0,qC(a);else{if(106==a.b)return;if(108==a.b)ZE(a.W,a.W.C,0),qC(a);else if(157==a.b)ZE(a.W,a.W.C,1),qC(a);else if(158==a.b)ZE(a.W,a.W.C,-1),qC(a);else if(202==a.b||203==a.b||204==a.b||201==a.b||205==a.b)a.L=1,X(a.W,0),a.W.E=a.W.C,205==a.b?(a.W.u=1,a.W.i[1]=a.W.s,a.W.i[0]=a.W.C,a.W.D=0):qC(a);else if(206<=a.b&&229>=a.b)a.L=2,$E(a.W),qC(a);else if(230==a.b)a.L=3,qC(a);else if(233<=a.b&&262>a.b)aF(a.W,!1),qC(a),a.L=3;
else if(107==a.b){if(a.pb.b)return;VE(a.W,a.W.C,kn(a.pb.d.Rb.a.gb,Eg));qC(a)}else if(105==a.b)bF(a.W);else if(300<a.b&&(a.c!=a.W.c[a.W.C]||18==a.c))a.W.c[a.W.C]=a.c,a.W.z[a.W.C]=0,a.W.w[a.W.C]=0,18==a.c&&(d=kn((sp(),tp).Rb.a.gb,Eg),1>d.length&&(d=Uc),VE(a.W,a.W.C,d)),qC(a)}else if(0<a.W.D)if(104==a.b)kC(a.W,a.W.D),a.W.D=0,qC(a);else if(106==a.b){d=a.W;c=a.W.D;if(0<d.a[d.G[c]]&&0<d.a[d.H[c]])rp(d.k,"Removal of substituent not possible.");else for(;;){c=0;for(b=d.s;1<=b;--b)0<d.a[b]&&b>c&&(c=b);if(0==
c)break;jC(d,c);d.a[c]=0}a.W.D=0;qC(a)}else if(201==a.b)cF(a.W,a.W.D),qC(a);else if(202==a.b||205==a.b)1==a.W.r[a.W.D]&&0==a.W.A[a.W.D]?(a.W.r[a.W.D]=2,qC(a)):a.W.r[a.W.D]=1,a.W.A[a.W.D]=0;else if(203==a.b)a.W.r[a.W.D]=2,a.W.A[a.W.D]=0,qC(a);else if(204==a.b)a.W.r[a.W.D]=3,a.W.A[a.W.D]=0,qC(a);else if(206<=a.b&&229>=a.b)a.L=2,$E(a.W),qC(a);else if(107==a.b){if(!a.pb.b)return;d=kn(a.pb.d.Rb.a.gb,Eg);a.W.r[a.W.D]=9;a.W.e[a.W.D]=d;qC(a)}else 105==a.b&&(a.eb=!0,a.G="Only atoms may be marked !");else if(0==
a.mb||a.jb){if(201>=a.b)return;++a.mb;a.d=a.mb;a.ab[a.mb]=new wE(a);a.W=a.ab[a.mb];a.jb=!1;202<=a.b&&204>=a.b||205==a.b?(dF(a.W),a.W.t=0,a.W.y[1]=0,a.W.I[1]=c,a.W.L[1]=d,a.W.C=1,a.W.E=1,a.L=1,X(a.W,0),205==a.b&&(a.W.I[2]=c+21.65,a.W.L[2]=d-12.5,a.W.i[0]=1,a.W.i[1]=2,a.W.u=1)):206<=a.b&&229>=a.b?(a.W.K=c,a.W.N=d,a.L=2,$E(a.W)):300<a.b?(dF(a.W),a.W.c[1]=a.c,a.W.t=0,a.W.y[1]=0,a.W.I[1]=c,a.W.L[1]=d,a.W.C=1,18==a.c&&(d=kn((sp(),tp).Rb.a.gb,Eg),1>d.length&&(d=Uc),VE(a.W,1,d))):230==a.b?GA(a,null):233<=
a.b&&262>a.b?(dF(a.W),a.W.t=0,a.W.y[1]=0,a.W.I[1]=c,a.W.L[1]=d,a.W.C=1,aF(a.W,!0)):Jz();qC(a)}sC(a.W);a.fb=!1;a.hb=!1;a.gb=!0;BA(a)}}function oC(a){a.fb=!1;a.hb=!1;a.gb=!1}
function AA(a,b){var c,b=b.toLowerCase();-1<b.indexOf("norbutton")?a.qb=!1:-1<b.indexOf("rbutton")&&(a.qb=!0);-1<b.indexOf("nohydrogens")?a.vb=!1:-1<b.indexOf("hydrogens")&&(a.vb=!0);-1<b.indexOf("keephs")&&(a.K=!0);-1<b.indexOf("removehs")&&(a.K=!1);-1<b.indexOf("noquery")?a.ob=!1:-1<b.indexOf("query")&&(a.ob=!0);-1<b.indexOf(tf)?a.rb=!1:-1<b.indexOf(Pf)&&(a.rb=!0);-1<b.indexOf("noautoez")?a.o=!1:-1<b.indexOf("autoez")&&(a.o=!0);-1<b.indexOf("nostereo")?a.yb=!1:-1<b.indexOf("stereo")&&(a.yb=!0);
-1<b.indexOf("nocanonize")?a.q=!1:-1<b.indexOf("canonize")&&(a.q=!0);-1<b.indexOf("nomultipart")?a.db=!1:-1<b.indexOf(pf)&&(a.db=!0);-1<b.indexOf("nonumber")?(a.lb=!1,a.p=!1):-1<b.indexOf(xf)&&(a.lb=!0,a.p=!1);-1<b.indexOf("newlook")?(a.ib=!0,a.O=1):-1<b.indexOf("oldlook")&&(a.ib=!1,a.O=0);-1<b.indexOf("autonumber")&&(a.p=!0,a.lb=!0);-1<b.indexOf("star")&&(a.xb=!0,a.lb=!0);-1<b.indexOf("polarnitro")&&(a.nb=!0);-1<b.indexOf("depict")&&(a.v=!0,a.V=0,a._=null,tE(a,1,a.mb,0));if(-1<b.indexOf("nodepict")){a.v=
!1;for(c=1;c<=a.mb;++c)eF(a.ab[c]),uE(a.ab[c]);a.x=1;a.V=24;a.W&&(a.W.v=!0)}-1<b.indexOf(pd)&&(a.w=!0);b.indexOf("writesmi");b.indexOf("writemi");b.indexOf("writemol");-1<b.indexOf("nocenter")&&(a.kb=!0);-1<b.indexOf("jmeh")&&(a.J=!0);-1<b.indexOf("showan")&&(a.ub=!0);a.rb&&(a.p=!0,a.db=!0);a.v||(a.w=!1);a.qb&&++yA;BA(a)}
function BA(a){var b,c,d;b=rx(a);!a.y||b.b!=a.y.b||b.a!=a.y.a||!a._||!a.F?(a.y=b,d=b.b-a.V,c=b.a-3*a.V-a.O,1>d&&(d=1),1>c&&(c=1),a._=ox(a,d,c),EE(a),a.v||(a.Ab=ox(a,b.b,2*a.V+a.O),JE(a),c=b.a-2*a.V+a.O,1>c&&(c=1),a.M=ox(a,a.V,c),DE(a),a.F=ox(a,d,a.V),CE(a))):(EE(a),a.v||(CE(a),a.z&&(JE(a),DE(a)),a.z=!0));a.fb=!0;a.hb=!0;a.gb=!0;a.eb=!0}
function OA(a,b){var c,d,e;e=j;for(d=1;d<=a.mb;++d){if(0<b&&(c=UE(a.ab[d]),c!=b))continue;c=a.ab[d];for(var f=void 0,g=void 0,h=void 0,i=void 0,l=g=f=void 0,m=void 0,h=void 0,m=j+c.s+ea+c.t,i=1;i<=c.s;++i){h=GE(c,i);c.k.J&&0<c.w[i]&&(h+=Yb,1<c.w[i]&&(h+=c.w[i]));0!=c.z[i]&&(0<c.z[i]?h+=Ba:h+=Ea,1<Si(c.z[i])&&(h+=Si(c.z[i])));g=-1;for(f=1;f<=c.x;++f)if(c.p[f][0]==i){g=c.p[f][1];break}c.k.xb&&0<c.b[i]&&(g=1);-1<g&&(h+=pb+g);m+=ea+h+ea+fF(0.055999999999999994*c.I[i],0,2)+ea+fF(0.055999999999999994*-c.L[i],
0,2)}for(i=1;i<=c.t;++i)f=c.G[i],g=c.H[i],l=c.r[i],1==c.A[i]?l=-1:2==c.A[i]?l=-2:3==c.A[i]?(l=-1,h=f,f=g,g=h):4==c.A[i]?(l=-2,h=f,f=g,g=h):10==c.A[i]&&(l=-5),9==c.r[i]&&(l=c.A[i]),m+=ea+f+ea+g+ea+l;c=m;0<c.length&&(0<e.length&&(e+=Ng),e+=c)}return e}function rE(a,b){var c,d,e;e=j;for(c=1;c<=a.mb;++c){if(0<b&&(d=UE(a.ab[c]),d!=b))continue;d=gF(a.ab[c]);0<d.length&&(0<e.length&&(e+=Za),e+=d)}return e}
function qC(a){var b,c,d,e;e=new hF;e.a=a.d;e.d=a.mb;c=!1;for(b=1;99>b;++b)if(d=a.ab[b])0<d.s&&(c=!0),e.b[b]=new sE(d),TA(e.b[b]);else break;e.e=a.rb;e.c=a.db;if(b=c?e:null)a=a.X,b=new lE(b),c=a.a.c,a.a.c=b,b.b=a.a,c&&(b.c=c,c.b=b),a.a=b}function IA(a,b,c){try{KE(a,b)?c&&qC(a):BA(a)}catch(d){if(d=Xh(d),y(d,67))BA(a);else throw d;}}function GA(a,b){try{QE(a,b)?qC(a):BA(a)}catch(c){if(c=Xh(c),y(c,67))BA(a);else throw c;}}
function QA(a){a.b=202;a.jb=!1;a.mb=0;a.d=0;a.W=new wE(a);a.W.q=0;a.$=null;a.x=1;a.gb=!0;BA(a)}function RE(a,b){var c,d;a.d=b.a;a.mb=b.d;for(c=1;99>c;++c)(d=b.b[c])?(a.ab[c]=new sE(d),TA(a.ab[c])):a.ab[c]=null;a.W=a.ab[a.d];a.rb=b.e;a.db=b.c}
function RA(a,b){var c;c=-1;C(b,"Select substituent")?(c=202,b=j):C(b,La)?c=235:C(b,Ma)?c=240:C(b,Ka)?c=260:C(b,Qa)?c=261:C(b,Ua)?c=241:C(b,Pa)?c=233:C(b,Oa)?c=236:C(b,Na)?c=237:C(b,Ta)?c=234:C(b,Sa)?c=243:C(b,Wa)?c=252:C(b,Ra)?c=244:C(b,Xa)?c=239:C(b,"-PO3H2")?c=251:C(b,Ha)?c=242:C(b,Fa)?c=245:C(b,Ga)&&(c=238);0<c?vp(a,c):b="Not known group!";a.eb=!0;a.G=b;BA(a)}function UA(a){var b;b=PA(a);BA(a);return b}
function yE(a,b,c,d,e){var f,g;f=a.S;g=lz(f,e);g>=a.V?(f=a.U,g=lz(f,e),KC(b,a.T)):KC(b,a.P);f=Cy(f.c).a;JC(b,e,c+~~((a.V-g)/2),d+~~((a.V-f)/2)+f)}function AE(a,b,c,d,e,f){var g,h;g=Cy(a.R.c).a;h=lz(a.R,f);KC(b,a.Q);(b.c=e)&&(b.d=Rf+(e.a>>16&255)+Ca+(e.a>>8&255)+Ca+(e.a&255)+za);JC(b,f,c+~~((a.V-h)/2),d+~~((a.V-g)/2)+g)}function up(a,b){a.p?0==b&&(a.u=-1,a.eb=!0,a.G=zd,BA(a)):(a.N?a.u=b:-1<a.u&&10>a.u?a.u=10*a.u+b:a.u=b,a.N=!1,0==a.u?(a.u=-1,a.eb=!0,a.G=zd):rp(a,a.u+ea),BA(a))}
function uA(){mE();mx.call(this);this.Db=(Io(),Io(),Uw).a;this.r=(Yx(),Zx);this.ab=v(iF,k,82,99,0);this.Y=new kx;this.tb=new jF;this.H=C((Jz(),Kz[Ge]),fc);this.D=D(Fq,k,1,[La,Ma,Ua,Ka,Qa,Pa,Oa,Na,Ta,Wa,Ra,Sa,Ha,Ga,Fa]);this.W=new wE(this);qE[0]=by;qE[1]=new $x(255,153,153);qE[2]=new $x(255,204,102);qE[3]=new $x(255,255,153);qE[4]=new $x(102,255,255);qE[5]=new $x(51,204,255);qE[6]=new $x(255,153,255)}s(522,354,Ug,uA);_.a=null;_.b=0;_.c=0;_.d=0;_.e=!1;_.f=null;_.i=null;_.j=null;_.k=null;_.n=null;
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function rF(a,b,c,d){var e,f,g,h,i;e=a.F[b][1];f=a.F[b][2];g=a.I[f]-a.I[e];h=-(a.L[f]-a.L[e]);i=Math.sqrt(g*g+h*h);0.001>i&&(i=0.001);h/=i;g/=i;1>(0>=(a.L[b]-a.L[e])*g+(a.I[b]-a.I[e])*h?0-((a.L[b]-a.L[e])*g+(a.I[b]-a.I[e])*h):(a.L[b]-a.L[e])*g+(a.I[b]-a.I[e])*h)?(g=a.I[b]-a.I[e],h=a.L[b]-a.L[e],i=Math.sqrt(g*g+h*h),0.001>i&&(i=0.001),h/=i,g/=i,d[0]=a.I[e]+i*g-c*h,d[1]=a.L[e]+c*g+i*h):(g=(a.I[e]+a.I[f])/2,e=(a.L[e]+a.L[f])/2,g=a.I[b]-g,h=a.L[b]-e,i=Math.sqrt(g*g+h*h),0.001>i&&(i=0.001),d[0]=a.I[b]+
c*g/i,d[1]=a.L[b]+c*h/i)}
function $E(a){var b,c,d,e,f,g,h,i,l,m,n,o,q;l=-1;h=6;switch(a.k.b){case 206:h=3;break;case 207:h=4;break;case 208:case 221:case 223:h=5;break;case 210:case 209:h=6;break;case 211:h=7;break;case 212:h=8;break;case 229:h=9}f=6.283185307179586/h;i=625*a.k.x*a.k.x/2/(1-Math.cos(f));i=Math.sqrt(i);if(0<a.C)if(2>a.y[a.C])tF(a,h,f,i);else if(a.k.bb){if(209==a.k.b||221==a.k.b||223==a.k.b){rp(a.k,"ERROR - cannot add aromatic spiro ring !");a.k.L=9;return}for(d=1;d<=a.y[a.C];++d)if(b=a.r[qF(a,a.C,a.F[a.C][d])],
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m=b,b=c,c=m);0==d&&(a.F[b][1]!=c?d=a.F[b][1]:d=a.F[b][2]);e=a.I[c]-a.I[b];g=a.L[c]-a.L[b];m=Math.sqrt(e*e+g*g);0.001>m&&(m=0.001);g/=m;e/=m;n=m/2;q=i*Math.sin(0.5*(3.141592653589793-f));m=1;0<(a.L[d]-a.L[b])*e-(a.I[d]-a.I[b])*g&&(q=-q,m=0);o=a.I[b]+n*e-q*g;q=a.L[b]+q*e+n*g;for(d=1;d<=h;++d)dF(a),n=f*(d+0.5)+3.141592653589793*m,a.I[a.s]=o+i*(Math.sin(n)*e-Math.cos(n)*g),a.L[a.s]=q+i*(Math.cos(n)*e+Math.sin(n)*g),1==m?(d==h&&(a.I[a.s]=a.I[b],a.L[a.s]=a.L[b]),d==h-1&&(a.I[a.s]=a.I[c],a.L[a.s]=a.L[c])):
(d==h-1&&(a.I[a.s]=a.I[b],a.L[a.s]=a.L[b]),d==h&&(a.I[a.s]=a.I[c],a.L[a.s]=a.L[c]))}else{b=0.5;6==h&&(b=0);for(d=1;d<=h;++d)dF(a),n=f*(d-b),a.I[a.s]=a.K+i*Math.sin(n),a.L[a.s]=a.N+i*Math.cos(n)}b=h;i=0;for(f=1;f<=b;++f)pC(a),a.r[a.t]=1,i=a.s-b+f,a.y[i]=2,a.G[a.t]=i,a.H[a.t]=i+1;a.H[a.t]=a.s-b+1;if(209==a.k.b){if(a.r[a.t-4]=2,a.r[a.t-2]=2,a.r[a.t]=2,0<a.D)if(1==a.r[a.D]){if(b=0,1<a.y[a.G[a.D]]&&(b=a.F[a.G[a.D]][1],i=a.G[a.D],b==a.H[a.D]&&(b=a.F[a.G[a.D]][2])),0==b&&1<a.y[a.H[a.D]]&&(b=a.F[a.H[a.D]][1],
i=a.H[a.D],b==a.H[a.D]&&(b=a.F[a.H[a.D]][2])),0<b)for(f=1;f<=a.t;++f)if(a.G[f]==b&&a.H[f]==i||a.G[f]==i&&a.H[f]==b){1!=a.r[f]&&(a.r[a.t-4]=1,a.r[a.t-2]=1,a.r[a.t]=1,a.r[a.t-5]=2,a.r[a.t-3]=2,a.r[a.t-1]=3);break}}else a.r[a.t-4]=1,a.r[a.t-2]=1,a.r[a.t]=1,a.r[a.t-5]=2,a.r[a.t-3]=2,a.r[a.t-1]=2}else if(221==a.k.b||223==a.k.b)if(0<a.D){if(1==a.r[a.D]){b=!1;for(f=1;f<=a.y[a.G[a.D]];++f)if(i=a.F[a.G[a.D]][f],1<a.r[qF(a,a.G[a.D],i)]){b=!0;break}for(f=1;f<=a.y[a.H[a.D]];++f)if(i=a.F[a.H[a.D]][f],1<a.r[qF(a,
a.H[a.D],i)]){b=!0;break}b||(a.r[a.D]=2)}a.r[a.t-4]=2;a.c[a.s-2]=5}else 0<a.C?221==a.k.b?(a.r[a.t-4]=1,a.r[a.t-2]=1,a.r[a.t-1]=1,a.r[a.t-3]=2,a.r[a.t]=2,a.c[a.s-1]=5):(a.r[a.t-3]=1,a.r[a.t-2]=1,a.r[a.t]=1,a.r[a.t-4]=2,a.r[a.t-1]=2,a.c[a.s-2]=5):(a.r[a.t-3]=1,a.r[a.t-2]=1,a.r[a.t]=1,a.r[a.t-4]=2,a.r[a.t-1]=2,a.c[a.s-2]=5);i=v(F,r,-1,a.s+1,1);for(f=1;f<=h;++f)b=a.s-h+f,c=a.t-h+f,a.F[b][1]=b-1,a.F[b][2]=b+1,b=a.G[c],e=a.H[c],a.J[c]=J(I(vB((a.I[b]+a.I[e])/2))),a.M[c]=J(I(vB((a.L[b]+a.L[e])/2)));a.F[a.s-
h+1][1]=a.s;a.F[a.s][2]=a.s-h+1;for(f=a.s-h+1;f<=a.s;++f){i[f]=0;g=51;c=0;for(b=1;b<=a.s-h;++b)e=a.I[f]-a.I[b],d=a.L[f]-a.L[b],e=e*e+d*d,50>e&&e<g&&(g=e,c=b);0<c&&(0==a.C||c==a.C)&&(i[f]=c)}g=a.t-h;f=g+1;a:for(;f<=g+h;++f)if(b=a.G[f],e=a.H[f],0<i[b]&&0<i[e]){for(c=1;c<=g;++c)if(a.G[c]==i[b]&&a.H[c]==i[e]||a.H[c]==i[b]&&a.G[c]==i[e])continue a;pC(a);a.r[a.t]=a.r[f];a.G[a.t]=i[b];a.F[i[b]][++a.y[i[b]]]=i[e];a.H[a.t]=i[e];a.F[i[e]][++a.y[i[e]]]=i[b];a.J[a.t]=J(I(vB((a.I[a.G[a.t]]+a.I[a.H[a.t]])/2)));
a.M[a.t]=J(I(vB((a.L[a.G[a.t]]+a.L[a.H[a.t]])/2)))}else 0<i[b]?(pC(a),a.r[a.t]=a.r[f],a.G[a.t]=i[b],a.F[i[b]][++a.y[i[b]]]=e,a.H[a.t]=e,a.F[e][++a.y[e]]=i[b],a.J[a.t]=J(I(vB((a.I[a.G[a.t]]+a.I[a.H[a.t]])/2))),a.M[a.t]=J(I(vB((a.L[a.G[a.t]]+a.L[a.H[a.t]])/2)))):0<i[e]&&(pC(a),a.r[a.t]=a.r[f],a.G[a.t]=i[e],a.F[i[e]][++a.y[i[e]]]=b,a.H[a.t]=b,a.F[b][++a.y[b]]=i[e],a.J[a.t]=J(I(vB((a.I[a.G[a.t]]+a.I[a.H[a.t]])/2))),a.M[a.t]=J(I(vB((a.L[a.G[a.t]]+a.L[a.H[a.t]])/2))));d=a.s-h;for(f=a.s;f>d;--f)if(0<i[f]&&
(jC(a,f),3==a.c[i[f]])){m=0;for(b=1;b<=a.y[i[f]];++b){e=a.F[i[f]][b];for(c=1;c<=a.t;++c)(a.G[c]==i[f]&&a.H[c]==e||a.G[c]==e&&a.H[c]==i[f])&&(m+=a.r[c])}if(4<m)for(c=g+1;c<=g+h;++c)a.r[c]=1}0<a.C&&sF(a,h);-1<l&&(a.C=l)}
function tF(a,b,c,d){var e,f,g,h,i,l;0==a.y[a.C]?(e=0,f=1):(e=a.F[a.C][1],f=a.I[a.C]-a.I[e],e=a.L[a.C]-a.L[e],g=Math.sqrt(f*f+e*e),0.001>g&&(g=0.001),e/=g,f/=g);i=a.I[a.C]+d*f;l=a.L[a.C]+d*e;for(g=1;g<=b;++g)dF(a),h=c*g-1.5707963267948966,a.I[a.s]=i+d*(Math.sin(h)*f-Math.cos(h)*e),a.L[a.s]=l+d*(Math.cos(h)*f+Math.sin(h)*e)}function sF(a,b){var c,d;0==b&&(b=a.s);for(c=a.s;c>a.s-b;--c)d=iC(a,c),0!=d&&(a.I[c]+=6,a.L[c]+=6)}
function qF(a,b,c){var d;for(d=1;d<=a.t;++d)if(a.G[d]==b&&a.H[d]==c||a.G[d]==c&&a.H[d]==b)return d;return 0}function uF(a,b,c){var d,e,f,g;e=Og;for(f=g=0;;){++g;for(d=1;d<=a.s;++d)if(fr(c[d])){e=c[d];break}for(d=1;d<=a.s;++d)fr(c[d])&&!Vq(c[d],e)&&(e=c[d]);for(d=1;d<=a.s;++d)$q(c[d],e)&&(b[d]=g,c[d]=Og,++f);if(f==a.s)break}return g==a.s}
function uE(a){var b,c,d;b=v(mC,k,-1,4,1);d=c=0;a.k&&a.k.y&&0<a.k.y.b&&(c=a.k.y.b-a.k.V,d=a.k.y.a-3*a.k.V);if(0>=c||0>=d)a.v=!0;else{nC(a,b);c=~~(c/2)-J(I(Math.round(b[0])));d=~~(d/2)-J(I(Math.round(b[1])));if(!a.k.kb)for(b=1;b<=a.s;++b)a.I[b]+=c,a.L[b]+=d;rC(a)}}
function nC(a,b){var c,d,e,f,g;f=9999;d=-9999;g=9999;e=-9999;for(c=1;c<=a.s;++c)a.I[c]<f&&(f=a.I[c]),a.I[c]>d&&(d=a.I[c]),a.L[c]<g&&(g=a.L[c]),a.L[c]>e&&(e=a.L[c]);b[0]=f+(d-f)/2;b[1]=g+(e-g)/2;b[2]=d-f;b[3]=e-g;25>b[2]&&(b[2]=25);25>b[3]&&(b[3]=25)}
function ZE(a,b,c){var d;if(1==c)++a.z[b];else if(-1==c)--a.z[b];else switch(d=vF(a,b),-1==d&&0==c&&(0==a.z[b]?a.z[b]=1:1==a.z[b]?a.z[b]=-1:-1==a.z[b]&&(a.z[b]=0)),a.c[b]){case 2:2<d&&rp(a.k,"Charge change not possible on this boron !");0==a.z[b]?a.z[b]=1:1==a.z[b]&&(a.z[b]=0);break;case 3:3<d?rp(a.k,"Charge change not possible on this carbon !"):4>d&&(0==a.z[b]?a.z[b]=-1:-1==a.z[b]?a.z[b]=1:1==a.z[b]&&(a.z[b]=0));break;case 4:case 7:3<d?rp(a.k,"Charge change not possible on multibonded N or P !"):
3==d&&0==a.z[b]?a.z[b]=1:3==d&&1==a.z[b]?a.z[b]=0:3>d&&0==a.z[b]?a.z[b]=1:3>d&&1==a.z[b]?a.z[b]=-1:3>d&&-1==a.z[b]&&(a.z[b]=0);break;case 5:case 8:case 13:2<d?rp(a.k,"Charge change not possible on multibonded O or S !"):2==d&&0==a.z[b]?a.z[b]=1:2==d&&1==a.z[b]?a.z[b]=0:2>d&&0==a.z[b]?a.z[b]=-1:2>d&&-1==a.z[b]?a.z[b]=1:2>d&&1==a.z[b]&&(a.z[b]=0);break;case 9:case 10:case 11:case 12:0==d&&0==a.z[b]?a.z[b]=-1:0==d&&-1==a.z[b]?a.z[b]=0:rp(a.k,"Charge change not possible on the halogen !");break;case 18:rp(a.k,
"Use X button to change charge on the X atom !")}}
function OE(a,b){var c,d,e,f,g;f=0;g=!1;for(a.a=v(F,r,-1,a.s+1,1);;){for(e=1;e<=a.s;++e)if(0==a.a[e]){a.a[e]=++f;g=!0;break}if(!g)break;for(;g;){g=!1;for(e=1;e<=a.t;++e)c=a.G[e],d=a.H[e],0<a.a[c]&&0==a.a[d]?(a.a[d]=f,g=!0):0<a.a[d]&&0==a.a[c]&&(a.a[c]=f,g=!0)}}if(2>f||!b)return f;g=v(F,r,-1,f+1,1);for(c=1;c<=a.s;++c)++g[a.a[c]];e=0;for(c=d=1;c<=f;++c)g[c]>e&&(e=g[c],d=c);for(c=a.s;1<=c;--c)a.a[c]!=d&&jC(a,c);uE(a);rp(a.k,"Smaller part(s) removed !");return 1}
function iC(a,b){var c,d,e,f,g;f=51;g=0;for(e=1;e<a.s;++e)b!=e&&(c=a.I[b]-a.I[e],d=a.L[b]-a.L[e],c=c*c+d*d,50>c&&c<f&&(f=c,g=e));return g}
function tC(a){var b,c,d;for(d=1;d<=a.t;++d){b=a.G[d];c=a.H[d];if(1==a.z[b]&&-1==a.z[c]||-1==a.z[b]&&1==a.z[c])if(1==a.r[d]||2==a.r[d]){if(3!=a.c[b]&&3!=a.c[c]&&a.k.nb)continue;if(1==a.c[b]||1==a.c[c])continue;if(2==a.c[b]||2==a.c[c])continue;if(9==a.c[b]||10==a.c[b]||11==a.c[b]||12==a.c[b]||9==a.c[c]||10==a.c[c]||11==a.c[c]||12==a.c[c])continue;a.z[b]=0;a.z[c]=0;++a.r[d];sC(a)}1==a.z[b]&&1==a.z[c]&&(2==a.r[d]?a.r[d]=1:3==a.r[d]&&(a.r[d]=2),sC(a));4==a.r[d]&&(a.r[d]=1)}}
function pF(a,b,c,d){var e,f;f=e=0;0<=a&&0<=b?e=1:0<=a&&0>b?e=2:0>a&&0>b?e=3:0>a&&0<=b&&(e=4);0<=c&&0<=d?f=1:0<=c&&0>d?f=2:0>c&&0>d?f=3:0>c&&0<=d&&(f=4);if(e<f)return 1;if(e>f)return-1;switch(e){case 1:case 4:return a<c?1:-1;case 2:case 3:return a>c?1:-1}return 0}function TA(a){var b;wF(a);b=a.r.length;a.J=v(F,r,-1,b,1);a.M=v(F,r,-1,b,1);rC(a);sC(a)}
function dF(a){var b,c;++a.s;a.s>a.c.length-1&&(c=a.c.length+10,b=v(F,r,-1,c,1),EB(a.c,b,a.c.length),a.c=b,b=v(F,r,-1,c,1),EB(a.z,b,a.z.length),a.z=b,b=v(F,r,-1,c,1),EB(a.w,b,a.w.length),a.w=b,b=v(F,r,-1,c,1),EB(a.b,b,a.b.length),a.b=b,b=v(Fq,k,1,c,0),EB(a.d,b,a.d.length),a.d=b,b=v(Fq,k,1,c,0),EB(a.n,b,a.n.length),a.n=b,b=v(mC,k,-1,c,1),EB(a.I,b,a.I.length),a.I=b,b=v(mC,k,-1,c,1),EB(a.L,b,a.L.length),a.L=b,b=uq([c,7]),EB(a.F,b,a.F.length),a.F=b,c=v(F,r,-1,c,1),EB(a.y,c,a.y.length),a.y=c);a.c[a.s]=
3;a.z[a.s]=0;a.b[a.s]=0;a.d[a.s]=null;a.w[a.s]=0}function HE(a,b,c,d,e,f){var g;g=J(I(vB(a.I[b]-c/2)));f||(g-=d-c);a=J(I(vB(a.L[b]-~~(e/2))));return new ex(g-1-1,a-1,d+1+2,e+2)}
function pC(a){var b,c;++a.t;a.t>a.r.length-1&&(b=a.r.length+10,c=v(F,r,-1,b,1),EB(a.G,c,a.G.length),a.G=c,c=v(F,r,-1,b,1),EB(a.H,c,a.H.length),a.H=c,c=v(F,r,-1,b,1),EB(a.r,c,a.r.length),a.r=c,c=v(F,r,-1,b,1),EB(a.A,c,a.A.length),a.A=c,c=v(F,r,-1,b,1),EB(a.J,c,a.J.length),a.J=c,c=v(F,r,-1,b,1),EB(a.M,c,a.M.length),a.M=c,b=v(Fq,k,1,b,0),EB(a.e,b,a.e.length),a.e=b);a.r[a.t]=1;a.A[a.t]=0;a.e[a.t]=null}
function XE(a,b){var c,d,e,f,g,h,i;if(0==a.s)return j;h=b;79<b.length&&(h=b.substr(0,76)+"...");h+=(mE(),ba);h+="JME 2013.01 "+new RB+"\n \n";h+=WE(a.s,3)+WE(a.t,3);h+="  0  0  0  0  0  0  0  0999 V2000\n";g=-1.7976931348623157E308;c=1.7976931348623157E308;for(e=1;e<=a.s;++e)a.L[e]>g&&(g=a.L[e]),a.I[e]<c&&(c=a.I[e]);for(e=1;e<=a.s;++e){h+=fF(0.055999999999999994*(a.I[e]-c),10,4)+fF(0.055999999999999994*(g-a.L[e]),10,4)+fF(0,10,4);i=GE(a,e);1==i.length?i+="  ":2==i.length?i+=ea:3<i.length&&(i="Q  ");
h+=ea+i;d=0;0<a.z[e]&&4>a.z[e]?d=4-a.z[e]:0>a.z[e]&&-4<a.z[e]&&(d=4-a.z[e]);i=" 0"+WE(d,3)+"  0  0  0  0  0  0  0";f=-1;for(d=1;d<=a.x;++d)if(a.p[d][0]==e){f=a.p[d][1];break}-1<f?i+=WE(f,3):i+="  0";h+=i+"  0  0\n"}for(e=1;e<=a.t;++e)g=a.r[e],1==a.r[e]?g=1:xF(a,e)&&(g=2),c=WE(a.G[e],3)+WE(a.H[e],3),d=0,1==a.r[e]&&1==a.A[e]?d=1:1==a.r[e]&&2==a.A[e]&&(d=6),1==a.r[e]&&3==a.A[e]&&(d=1,c=WE(a.H[e],3)+WE(a.G[e],3)),1==a.r[e]&&4==a.A[e]&&(d=6,c=WE(a.H[e],3)+WE(a.G[e],3)),h+=c+WE(g,3)+WE(d,3)+"  0  0  0\n";
for(e=1;e<=a.s;++e)0!=a.z[e]&&(h+="M  CHG  1"+WE(e,4)+WE(a.z[e],4)+ba);return h+"M  END\n"}
function gF(a){var b,c,d,e,f,g,h,i,l,m,n,o,q,w,G,z,K,O,S,ca,N,ac,sc,Ff,rb,Ad,Bd,Cd,fb,tc;n=v(F,r,-1,a.s+10,1);o=v(F,r,-1,a.s+10,1);l=v(F,r,-1,a.s+1,1);m=v(F,r,-1,7,1);rb=v(F,r,-1,a.s+1,1);w=v(yF,k,-1,a.s+1,2);G=v(yF,k,-1,a.t+1,2);ac=0;if(0==a.s)return j;OE(a,!0);Ff=!0;for(i=1;i<=a.t;++i)if(9==a.r[i]){Ff=!1;break}if(a.k.q&&Ff){zF(a);tC(a);AF(a,G);BF(a,w,G);var yb,fd,Ne,Rb,fe,gd,hd,bb,eG,Ed,t,ra,dm,em,tr,Ve,Ja,fm,gm,xc,hm;yb=v(F,r,-1,a.s+1,1);fd=v(F,r,-1,a.s+1,1);bb=v(CF,k,-1,a.s+1,3);var ur=a.s,im,
bh,vr,Vf,$i,ne,We;$i=v(CF,k,-1,ur+2,3);ne=v(F,r,-1,100,1);We=5;Vf=0;ne[0]=3;$i[1]=Qg;$i[2]=Rg;vr=2;if(!(3>ur))for(;We<ne[Vf]*ne[Vf];){bh=0;for(im=!0;im&&bh<=Vf&&We>=ne[bh]*ne[bh];)0==We%ne[bh]?im=!1:++bh;if(im){$i[++vr]=cr(We);if(vr>=ur)break;Vf<ne.length-1&&(++Vf,ne[Vf]=We)}We+=2}for(t=1;t<=a.s;++t){for(ra=gm=1;ra<=a.t;++ra)(a.G[ra]==t||a.H[ra]==t)&&(gm*=a.f[ra]);fm=a.c[t];18==fm&&(hm=a.n[t],gd=hm.charCodeAt(0)-65+1,hd=0,1<hm.length&&(hd=hm.charCodeAt(1)-97),0>gd&&(gd=0),0>hd&&(hd=0),fm=28*gd+hd);
Ve=0;-2>a.z[t]?Ve=1:-2==a.z[t]?Ve=2:-1==a.z[t]?Ve=3:1==a.z[t]?Ve=4:2==a.z[t]?Ve=5:2<a.z[t]&&(Ve=6);xc=1;bb[t]=cr(gm);xc*=126;bb[t]=Yq(bb[t],cr(a.w[t]*xc));xc*=7;bb[t]=Yq(bb[t],cr(Ve*xc));xc*=7;bb[t]=Yq(bb[t],cr(fm*xc));xc*=783;bb[t]=Yq(bb[t],cr(a.y[t]*xc))}for(fe=0;!uF(a,yb,bb);){tr=!1;for(t=1;t<=a.s;++t)yb[t]!=fd[t]&&(fd[t]=yb[t],tr=!0);if(tr){for(t=1;t<=a.s;++t){bb[t]=Pg;for(ra=1;ra<=a.y[t];++ra)bb[t]=gr(bb[t],$i[yb[a.F[t][ra]]])}fe=0}else if(0<fe){for(t=1;t<=a.s;++t)bb[t]=Pg;t=1;a:for(;t<=a.s-
1;++t)for(ra=t+1;ra<=a.s;++ra)if(yb[t]==yb[ra]){bb[t]=Qg;break a}}else{for(t=1;t<=a.s;++t){bb[t]=Pg;for(ra=1;ra<=a.y[t];++ra)Ne=a.F[t][ra],bb[t]=gr(bb[t],cr(a.c[Ne]*a.f[qF(a,t,Ne)]))}fe=1}uF(a,yb,bb);for(t=1;t<=a.s;++t)bb[t]=cr(fd[t]*a.s+yb[t])}for(t=1;t<=a.s;++t)fd[t]=yb[t];for(Ja=1;Ja<=a.s;++Ja)for(t=1;t<=a.s;++t)if(fd[t]==Ja){a.c[0]=a.c[t];a.z[0]=a.z[t];a.I[0]=a.I[t];a.L[0]=a.L[t];a.y[0]=a.y[t];a.c[t]=a.c[Ja];a.z[t]=a.z[Ja];a.I[t]=a.I[Ja];a.L[t]=a.L[Ja];a.y[t]=a.y[Ja];a.c[Ja]=a.c[0];a.z[Ja]=a.z[0];
a.I[Ja]=a.I[0];a.L[Ja]=a.L[0];a.y[Ja]=a.y[0];fd[t]=fd[Ja];fd[Ja]=Ja;a.n[0]=a.n[t];a.n[t]=a.n[Ja];a.n[Ja]=a.n[0];a.b[0]=a.b[t];a.b[t]=a.b[Ja];a.b[Ja]=a.b[0];a.d[0]=a.d[t];a.d[t]=a.d[Ja];a.d[Ja]=a.d[0];a.w[0]=a.w[t];a.w[t]=a.w[Ja];a.w[Ja]=a.w[0];break}for(t=1;t<=a.x;++t)a.p[t][0]=yb[a.p[t][0]];for(t=1;t<=a.t;++t)a.G[t]=yb[a.G[t]],a.H[t]=yb[a.H[t]],a.G[t]>a.H[t]&&(Ed=a.G[t],a.G[t]=a.H[t],a.H[t]=Ed,1==a.A[t]?a.A[t]=3:2==a.A[t]?a.A[t]=4:3==a.A[t]?a.A[t]=1:4==a.A[t]&&(a.A[t]=2));for(t=1;t<a.t;++t){em=dm=
a.s;Rb=0;for(ra=t;ra<=a.t;++ra)a.G[ra]<dm?(dm=a.G[ra],em=a.H[ra],Rb=ra):a.G[ra]==dm&&a.H[ra]<em&&(em=a.H[ra],Rb=ra);Ed=a.G[t];a.G[t]=a.G[Rb];a.G[Rb]=Ed;Ed=a.H[t];a.H[t]=a.H[Rb];a.H[Rb]=Ed;Ed=a.r[t];a.r[t]=a.r[Rb];a.r[Rb]=Ed;Ed=a.A[t];a.A[t]=a.A[Rb];a.A[Rb]=Ed;eG=a.e[t];a.e[t]=a.e[Rb];a.e[Rb]=eG}TA(a);sC(a);AF(a,G);BF(a,w,G)}else{AF(a,G);a.f=v(F,r,-1,a.t+1,1);for(q=1;q<=a.t;++q)a.f[q]=a.r[q]}c=1;a.a=v(F,r,-1,a.s+1,1);tc=1;a.a[1]=1;for(ca=0;;){N=0;for(q=1;q<=a.y[c];++q)if(g=a.F[c][q],0<a.a[g]){if(!(a.a[g]>
a.a[c])&&g!=rb[c]){sc=!0;for(K=1;K<=ac;++K)if(n[K]==c&&o[K]==g||n[K]==g&&o[K]==c){sc=!1;break}sc&&(++ac,n[ac]=c,o[ac]=g)}}else m[++N]=g;if(0==N){if(tc==a.s)break;c=l[ca--]}else if(1==N)rb[m[1]]=c,c=m[1],a.a[c]=++tc;else{l[++ca]=c;e=0;for(q=1;q<=N;++q)if(i=qF(a,m[q],c),!G[i]){e=m[q];break}if(0==e)for(q=1;q<=N;++q)if(i=qF(a,m[q],c),2==a.f[i]||3==a.f[i]){e=m[q];break}0==e&&(e=m[1]);rb[e]=c;c=e;a.a[e]=++tc}}rb=v(F,r,-1,a.s+1,1);b=v(F,r,-1,a.s+1,1);O=v(yF,k,-1,a.s+1,2);Ad=v(yF,k,-1,a.s+1,2);f=tc=ca=0;
for(q=1;q<=a.s;++q)if(1==a.a[q]){c=q;break}a:for(;;){0<f&&(rb[c]=f);b[++tc]=c;for(a.a[c]=0;;){N=e=0;S=a.s+1;q=1;b:for(;q<=a.y[c];++q){g=a.F[c][q];for(z=1;z<=ac;++z)if(n[z]==g&&o[z]==c||n[z]==c&&o[z]==g)continue b;0<a.a[g]&&(++N,a.a[g]<S&&(e=g,S=a.a[g]))}if(0==e){if(0==ca)break a;Ad[c]=!0;c=l[ca--]}else break}f=c;c=e;1<N&&(l[++ca]=f,O[e]=!0)}Bd=v(F,r,-1,a.t+1,1);Cd=v(F,r,-1,a.s+1,1);if(a.k.yb){var gG=rb,wI=ac,wr,hG,ch,oe,xr,yr,Ia,aj,zr;ch=v(F,r,-1,a.s+1,1);for(Ia=1;Ia<=a.s;++Ia)ch[b[Ia]]=Ia;xr=v(yF,
k,-1,a.t+1,2);for(Ia=1;Ia<=a.s;++Ia)wr=b[Ia],hG=gG[wr],oe=qF(a,wr,hG),0!=oe&&(DF(a,oe,ch,Bd,G),xr[oe]=!0);for(Ia=1;Ia<=a.t;++Ia)xr[Ia]||DF(a,Ia,ch,Bd,G);Ia=1;a:for(;Ia<=a.s;++Ia)if(!(2>a.y[Ia]||4<a.y[Ia])){yr=zr=0;for(aj=1;aj<=a.y[Ia];++aj){oe=qF(a,Ia,a.F[Ia][aj]);if(5==a.f[oe])continue a;1==a.r[oe]&&0!=EF(a,oe,Ia)&&++zr;2==a.r[oe]&&(yr=a.F[Ia][aj])}if(0!=zr)if(0<yr){var da=a,jG=Ia,Xe=ch,Jc=Cd,cc=void 0,bj=void 0,yc=void 0,pe=void 0,zc=void 0,jm=void 0,km=void 0,lm=void 0,Fd=void 0,Kc=void 0,Lc=void 0,
Ar=void 0,cj=void 0,Gd=void 0,dj=void 0,qe=void 0,ej=void 0,Br=void 0,fj=void 0,re=void 0,kG=void 0,Ye=void 0,lG=void 0,Cr=void 0,gj=void 0,Ze=void 0,Lc=1,bj=jG,cc=v(F,r,-1,da.s+1,1);for(cc[1]=jG;;){Ar=!1;for(Kc=1;Kc<=da.y[bj];++Kc)if(yc=da.F[bj][Kc],!(yc==cc[1]||yc==cc[Lc-1]))if(pe=qF(da,bj,yc),2==da.r[pe]&&5!=da.f[pe]){bj=cc[++Lc]=yc;Ar=!0;break}if(!Ar)break}if(!(0==Lc%2||2>da.y[cc[Lc]]||3<da.y[cc[Lc]])){Ze=cc[1];zc=cc[~~((Lc+1)/2)];Fd=cc[Lc];Ye=re=qe=Gd=0;Cr=Br=!1;for(Kc=1;Kc<=da.y[Ze];++Kc)yc=
da.F[Ze][Kc],pe=qF(da,Ze,yc),1!=da.r[pe]||5==da.f[pe]||(0==Gd?Gd=yc:qe=yc);0<Xe[qe]&&Xe[Gd]>Xe[qe]&&(jm=Gd,Gd=qe,qe=jm);cj=Gd;0==Gd&&(cj=qe,Br=!0);for(Kc=1;Kc<=da.y[Fd];++Kc)yc=da.F[Fd][Kc],pe=qF(da,Fd,yc),1!=da.r[pe]||5==da.f[pe]||(0==re?re=yc:Ye=yc);0<Xe[Ye]&&Xe[re]>Xe[Ye]&&(jm=re,re=Ye,Ye=jm);fj=re;0==re&&(fj=Ye,Cr=!0);dj=EF(da,qF(da,Ze,Gd),Ze);ej=EF(da,qF(da,Ze,qe),Ze);kG=EF(da,qF(da,Fd,re),Fd);lG=EF(da,qF(da,Fd,Ye),Fd);1<(0>dj+ej?-(dj+ej):dj+ej)||0!=kG||0!=lG?rp(da.k,"Bad stereoinfo on allene !"):
(km=da.I[cc[Lc-1]]-da.I[Fd],lm=da.L[cc[Lc-1]]-da.L[Fd],gj=Math.sqrt(km*km+lm*lm),0.001>gj&&(gj=0.001),0<(da.L[fj]-da.L[cc[Lc-1]])*(km/gj)-(da.I[fj]-da.I[cc[Lc-1]])*(lm/gj)?Jc[zc]=1:Jc[zc]=-1,Br&&(Jc[zc]*=-1),Cr&&(Jc[zc]*=-1),cj==Gd&&0>dj&&(Jc[zc]*=-1),cj==qe&&0>ej&&(Jc[zc]*=-1),Xe[cj]>Xe[fj]&&(Jc[zc]*=-1))}}else b:{var nb=a,Va=Ia,Dr=gG,mG=ch,nG=n,oG=o,xI=wI,mm=Cd,nm=void 0,Mc=void 0,Er=void 0,dh=void 0,wa=void 0,eh=void 0,jd=void 0,hj=void 0,Hd=void 0,Ib=void 0,aa=void 0,$=void 0,se=void 0,om=void 0,
Nc=void 0,E=void 0,pm=void 0,$=v(F,r,-1,4,1),om=v(F,r,-1,4,1),ij=void 0,Oc=void 0,qm=void 0,rm=void 0,Fr=void 0,jj=void 0,jj=-1;0<Dr[Va]&&($[++jj]=Dr[Va]);for(Oc=1;Oc<=xI;++Oc)nG[Oc]==Va&&($[++jj]=oG[Oc]),oG[Oc]==Va&&($[++jj]=nG[Oc]);for(Oc=jj+1;Oc<nb.y[Va];++Oc){Fr=nb.s+1;qm=1;c:for(;qm<=nb.y[Va];++qm){ij=nb.F[Va][qm];for(rm=0;rm<Oc;++rm)if(ij==$[rm])continue c;mG[ij]<Fr&&(Fr=mG[ij],$[Oc]=ij)}}0==Dr[Va]&&0<nb.w[Va]?($[3]=$[2],$[2]=$[1],$[1]=$[0],$[0]=-1):0<nb.w[Va]&&($[3]=$[2],$[2]=$[1],$[1]=-1);
for(wa=hj=eh=dh=pm=jd=Ib=0;4>wa;++wa)0>=$[wa]||(nm=qF(nb,Va,$[wa]),om[wa]=EF(nb,nm,Va),0<om[wa]?(++Ib,pm=$[wa],eh=$[wa]):0>om[wa]?(++jd,dh=$[wa],eh=$[wa]):hj=$[wa]);Hd=Ib+jd;E=v(F,r,-1,4,1);Nc=0;if(3==nb.y[Va]){if(1==Ib&&1==jd||3==Hd&&0<Ib&&0<jd){rp(nb.k,"Error in C3H stereospecification !");break b}se=$[0];1==Hd?se=eh:2==Hd&&(se=hj);aa=oF(nb,Va,se,$);E[0]=eh;E[1]=-1;E[2]=aa[2];E[3]=aa[1];0<Ib?Nc=1:Nc=-1}else if(4==nb.y[Va])if(1==Hd)aa=oF(nb,Va,eh,$),E[0]=aa[0],E[1]=aa[3],E[2]=aa[2],E[3]=aa[1],0<
Ib?Nc=1:Nc=-1;else{se=$[0];1<hj&&(se=hj);1==Ib?se=pm:1==jd&&(se=dh);aa=oF(nb,Va,se,$);Mc=v(F,r,-1,4,1);for(wa=0;4>wa;++wa)nm=qF(nb,Va,aa[wa]),Mc[wa]=EF(nb,nm,Va);if(4==Hd){if(0==Ib||0==jd){rp(nb.k,"Error in C4 stereospecification !");break b}if(1==Ib||1==jd)E[0]=aa[0],E[1]=aa[3],E[2]=aa[2],E[3]=aa[1],Nc=Mc[0];else{for(wa=0;4>wa;++wa)-1==Mc[wa]&&(Mc[wa]=0);Hd=2}}else if(3==Hd)if(3==Ib||3==jd)E[0]=aa[0],E[1]=aa[3],E[2]=aa[2],E[3]=aa[1],0<Ib?Nc=-1:Nc=1;else{1==Ib?Ib=Er=1:jd=Er=-1;for(wa=0;4>wa;++wa)Mc[wa]==
Er&&(Mc[wa]=0);Hd=2}if(2==Hd)if(1==Ib&&1==jd)aa[1]==dh?(aa[1]=aa[2],aa[2]=aa[3]):aa[2]==dh&&(aa[2]=aa[3]),E[0]=pm,E[1]=dh,E[2]=aa[2],E[3]=aa[1],Nc=1;else{if(Mc[0]==Mc[1]||Mc[1]==Mc[2]){rp(nb.k,"Error in C4 stereospecification ! 2/0r");break b}0!=Mc[0]?(E[0]=aa[0],E[1]=aa[2],E[2]=aa[1],E[3]=aa[3]):(E[0]=aa[1],E[1]=aa[3],E[2]=aa[2],E[3]=aa[0]);1<Ib?Nc=1:Nc=-1}}var hb=void 0;$[0]==E[1]?(hb=E[0],E[0]=E[1],E[1]=hb,hb=E[2],E[2]=E[3],E[3]=hb):$[0]==E[2]?(hb=E[2],E[2]=E[0],E[0]=hb,hb=E[1],E[1]=E[3],E[3]=
hb):$[0]==E[3]&&(hb=E[3],E[3]=E[0],E[0]=hb,hb=E[1],E[1]=E[2],E[2]=hb);$[1]==E[2]?(hb=E[1],E[1]=E[2],E[2]=hb,hb=E[2],E[2]=E[3],E[3]=hb):$[1]==E[3]&&(hb=E[1],E[1]=E[3],E[3]=hb,hb=E[2],E[2]=E[3],E[3]=hb);E[2]==$[2]?mm[Va]=1:E[2]==$[3]?mm[Va]=-1:rp(nb.k,"Error in stereoprocessing ! - t30");mm[Va]*=Nc}}}fb=new DB;h=v(F,r,-1,a.s+1,1);for(q=1;q<=a.s;++q)h[b[q]]=q;for(q=1;q<=a.s;++q){c=b[q];O[c]&&wm(fb.a,ya);0<rb[q]&&FF(a,c,rb[c],fb,Bd);var fh=w[c],Ab=void 0,kj=void 0,gh=void 0,P=void 0,P=Uc,Ab=!1;0!=a.z[c]&&
(Ab=!0);0!=Cd[c]&&(Ab=!0);gh=-1;for(kj=1;kj<=a.x;++kj)if(a.p[kj][0]==c){gh=a.p[kj][1];break}-1<gh&&(Ab=!0);a.k.xb&&0<a.b[c]&&(Ab=!0,gh=1);switch(a.c[c]){case 2:P=Fb;break;case 3:fh?P="c":P=Jb;break;case 4:fh?(P=qf,0<a.w[c]&&(Ab=!0)):P=ic;break;case 5:fh?P="o":P=pc;break;case 7:fh?(P="p",0<a.w[c]&&(Ab=!0)):P=rc;break;case 8:fh?P=Yf:P=Gc;break;case 13:fh?P=$f:P=Ic;Ab=!0;break;case 6:P=Pc;Ab=!0;break;case 9:P=Ub;break;case 10:P=Nb;break;case 11:P=Hb;break;case 12:P=$b;break;case 1:P=Yb;Ab=!0;break;case 19:P=
uc;Ab=!0;break;case 20:P=vc;Ab=!0;break;case 21:P=wc;Ab=!0;break;case 22:P=Ac;Ab=!0;break;case 18:Ab=!0,P=a.n[c],(C(P,Aa)||C(P,Zc)||C(P,Bb))&&(Ab=!1)}Ab&&(P=Vc+P,1==Cd[c]?P+=zb:-1==Cd[c]&&(P+="@@"),1==a.w[c]?P+=Yb:1<a.w[c]&&(P+=Yb+a.w[c]),0!=a.z[c]&&(0<a.z[c]?P+=Ba:P+=Ea,1<Si(a.z[c])&&(P+=Si(a.z[c]))),-1<gh&&(P+=pb+gh),P+=Xc);wm(fb.a,P);for(z=1;z<=ac;++z)if(n[z]==c||o[z]==c)d=o[z],d==c&&(d=n[z]),h[c]<h[d]&&FF(a,n[z],o[z],fb,Bd),9<z&&wm(fb.a,"%"),xm(fb,j+(new T(z)).a);Ad[c]&&wm(fb.a,za)}return hn(fb.a)}
function jC(a,b){var c,d,e,f;f=0;for(e=1;e<=a.t;++e)c=a.G[e],d=a.H[e],c!=b&&d!=b&&(++f,a.G[f]=c,c>b&&--a.G[f],a.H[f]=d,d>b&&--a.H[f],a.r[f]=a.r[e],a.A[f]=a.A[e],a.J[f]=a.J[e],a.M[f]=a.M[e],a.e[f]=a.e[e]);a.t=f;for(e=b;e<a.s;++e){a.c[e]=a.c[e+1];a.z[e]=a.z[e+1];a.I[e]=a.I[e+1];a.L[e]=a.L[e+1];a.w[e]=a.w[e+1];a.b[e]=a.b[e+1];a.d[e]=a.d[e+1];a.y[e]=a.y[e+1];a.n[e]=a.n[e+1];for(f=1;f<=a.y[e];++f)a.F[e][f]=a.F[e+1][f]}--a.s;if(0==a.s)vE(a.k);else{for(e=1;e<=a.s;++e){d=0;for(f=1;f<=a.y[e];++f)c=a.F[e][f],
c==b?++a.w[e]:(c>b&&--c,a.F[e][++d]=c);a.y[e]=d}e=1;a:for(;e<=a.x;++e)if(a.p[e][0]==b){for(f=e;f<a.x;++f)a.p[f][0]=a.p[f+1][0],a.p[f][1]=a.p[f+1][1];--a.x;break a}for(e=1;e<=a.x;++e)a.p[e][0]>b&&--a.p[e][0]}}
function kC(a,b){var c,d,e,f;c=a.G[b];d=a.H[b];for(e=b;e<a.t;++e)a.G[e]=a.G[e+1],a.H[e]=a.H[e+1],a.r[e]=a.r[e+1],a.A[e]=a.A[e+1],a.J[e]=a.J[e+1],a.M[e]=a.M[e+1],a.e[e]=a.e[e+1];--a.t;f=0;for(e=1;e<=a.y[c];++e)a.F[c][e]!=d&&(a.F[c][++f]=a.F[c][e]);a.y[c]=f;f=0;for(e=1;e<=a.y[d];++e)a.F[d][e]!=c&&(a.F[d][++f]=a.F[d][e]);a.y[d]=f;c<d&&(f=c,c=d,d=f);0==a.y[c]&&jC(a,c);0==a.y[d]&&jC(a,d)}
function zF(a){var b,c,d;if(!a.k.K){c=a.s;a:for(;1<=c;--c)if(d=a.F[c][1],1==a.c[c]&&1==a.y[c]&&0==a.z[c]&&1!=a.c[d]&&18>a.c[d]){for(b=1;b<=a.x;++b)if(a.p[b][0]==c)continue a;b=qF(a,c,d);1==a.r[b]&&(0==a.A[b]||!a.k.yb)&&jC(a,c)}}}function wF(a){var b;b=a.c.length;a.F=uq([b,7]);a.y=v(F,r,-1,b,1);for(b=1;b<=a.s;++b)a.y[b]=0;for(b=1;b<=a.t;++b)6>a.y[a.G[b]]&&(a.F[a.G[b]][++a.y[a.G[b]]]=a.H[b]),6>a.y[a.H[b]]&&(a.F[a.H[b]][++a.y[a.H[b]]]=a.G[b])}
function BF(a,b,c){var d,e,f,g,h,i,l,m,n;a.f=v(F,r,-1,a.t+1,1);n=v(yF,k,-1,a.s+1,2);for(i=1;i<=a.s;++i){n[i]=!1;b[i]=!1;a:{d=void 0;for(d=1;d<=a.y[i];++d)if(c[qF(a,i,a.F[i][d])]){d=!0;break a}d=!1}if(d&&!(3<a.y[i]+a.w[i]))switch(a.c[i]){case 3:case 4:case 7:case 5:case 8:case 13:n[i]=!0;break;case 18:n[i]=!0}}for(h=1;h<=a.t;++h)1==a.r[h]?a.f[h]=1:xF(a,h)?a.f[h]=2:3==a.r[h]&&(a.f[h]=3);h=1;a:for(;h<=a.t;++h)if(c[h]&&(f=a.G[h],g=a.H[h],n[f]&&n[g])){d=v(yF,k,-1,a.s+1,2);for(i=1;i<=a.y[f];++i)e=a.F[f][i],
e!=g&&n[e]&&(d[e]=!0);for(m=!1;;){for(i=1;i<=a.s;++i){m=!1;if(d[i]&&n[i]&&i!=f)for(l=1;l<=a.y[i];++l){e=a.F[i][l];if(e==g){b[f]=!0;b[g]=!0;a.f[h]=5;continue a}!d[e]&&n[e]&&(m=d[e]=!0)}if(m)break}if(!m)break}}}function rC(a){var b,c,d;for(d=1;d<=a.t;++d)b=a.G[d],c=a.H[d],a.J[d]=J(I(vB((a.I[b]+a.I[c])/2))),a.M[d]=J(I(vB((a.L[b]+a.L[c])/2)))}function AF(a,b){var c;for(c=1;c<=a.t;++c)IE(a,a.G[c],a.H[c])?b[c]=!1:b[c]=!0}function GE(a,b){var c;c=(mE(),EA)[a.c[b]];18==a.c[b]&&(c=a.n[b]);return c}
function xF(a,b){return 2==a.r[b]?!0:!1}function IE(a,b,c){var d,e,f,g;g=1;a.a=v(F,r,-1,a.s+1,1);for(d=1;d<=a.s;++d)a.a[d]=0;for(d=a.a[b]=1;d<=a.y[b];++d)a.F[b][d]!=c&&(a.a[a.F[b][d]]=++g);for(f=!1;;){for(d=1;d<=a.s;++d){f=!1;if(0<a.a[d]&&d!=b)for(e=1;e<=a.y[d];++e)0==a.a[a.F[d][e]]&&(a.a[a.F[d][e]]=++g,f=!0);if(f)break}if(!f)break}return 0==a.a[c]}
function bF(a){var b,c;a.k.N=!0;if(a.k.xb)a.j=-1,0==a.b[a.C]?a.b[a.C]=4:a.b[a.C]=0;else{for(b=1;b<=a.x;++b)if(a.C==a.p[b][0]){if(-1==a.k.u){for(;b<a.x;++b)a.p[b][0]=a.p[b+1][0],a.p[b][1]=a.p[b+1][1];--a.x}else c=a.k.u,a.k.p&&(a.k.bb||++a.q,c=a.q),a.p[b][1]=c;return}b=a.p.length;++a.x>b-1&&(b=uq([b+5,2]),EB(a.p,b,a.p.length),a.p=b);a.p[a.x][0]=a.C;c=a.k.u;a.k.p&&(a.k.bb||++a.q,c=a.q);a.p[a.x][1]=c}}function CA(a){var b;a.x=0;a.q=0;gF(a);for(b=1;b<=a.s;++b)a.C=b,bF(a);a.C=0}
function UE(a){var b,c;b=v(mC,k,-1,4,1);nC(a,b);c=a.k.y.b;a.k.v||(c-=a.k.V);return b[0]<~~(c/2)-24?1:b[0]>~~(c/2)+24?3:2}function eF(a){var b,c,d,e,f;e=f=0;for(d=1;d<=a.t;++d)b=a.I[a.G[d]]-a.I[a.H[d]],c=a.L[a.G[d]]-a.L[a.H[d]],f+=Math.sqrt(b*b+c*c);0<a.t?(f/=a.t,e=25/f):1<a.s&&(e=75/Math.sqrt((a.I[1]-a.I[2])*(a.I[1]-a.I[2])+(a.L[1]-a.L[2])*(a.L[1]-a.L[2])));for(d=1;d<=a.s;++d)a.I[d]*=e,a.L[d]*=e}
function VE(a,b,c){var d,e,f,g,h;if(0==c.indexOf(Vc)&&wB(c,Xc))c=c.substr(1,c.length-1-1),a.c[b]=18,a.n[b]=c,a.w[b]=0;else{f=!1;-1<c.indexOf(Ca)&&(f=!0);-1<c.indexOf(sb)&&(f=!0);-1<c.indexOf(oa)&&(f=!0);-1<c.indexOf("!")&&(f=!0);d=c.indexOf(pb);e=c.indexOf(Yb);g=Ri(c.indexOf(Ba),c.indexOf(Ea));if(-1<d){h=ft(c,d+1);try{a.k.u=Xz(h,10)}catch(i){if(i=Xh(i),y(i,67))a.k.u=0;else throw i;}a.C=b;bF(a);c=c.substr(0,d-0);a.C=0}if(f)a.n[b]=c,a.c[b]=18,a.w[b]=0;else{d=c;0<e?d=c.substr(0,e-0):0<g&&(d=c.substr(0,
g-0));a.c[b]=C(d,Jb)?3:C(d,Fb)?2:C(d,ic)?4:C(d,pc)?5:C(d,rc)?7:C(d,Gc)?8:C(d,Ub)?9:C(d,Nb)?10:C(d,Hb)?11:C(d,$b)?12:C(d,Yb)?1:C(d,Ic)?13:C(d,Pc)?6:C(d,uc)?19:C(d,vc)?20:C(d,wc)?21:C(d,Ac)?22:18;18==a.c[b]&&(a.n[b]=d);c+=ea;d=0;0<e&&(d=1,e=eB(c,++e),48<=e&&57>=e&&(d=e-48));18==a.c[b]&&(a.w[b]=d);d=0;if(0<g&&(e=eB(c,g++),43==e?d=1:45==e&&(d=-1),0!=d&&(e=eB(c,g++),!(48<=e&&57>=e)))){for(;43==e;)++d,e=eB(c,g++);for(;45==e;)--d,e=eB(c,g++)}a.z[b]=d}}}
function HA(a,b,c){var d,e;a.j=1;c&&(a.j=-1);b=new qA(b);try{for(;b.j=jA(b,b.a),b.j<b.i;)d=rB(Xz(mA(b),10)).a,c=e=rB(Xz(mA(b),10)).a,(0>c||6<c)&&(c=0),a.b[d]=c}catch(f){if(f=Xh(f),y(f,67))um(f);else throw f;}}function FF(a,b,c,d,e){b=qF(a,b,c);5!=a.f[b]&&xF(a,b)?wm(d.a,vb):3==a.r[b]?wm(d.a,oa):9==a.r[b]?(e=xb,a=a.e[b],null!=a&&(e=a),wm(d.a,e)):1==e[b]?wm(d.a,$a):-1==e[b]&&wm(d.a,Wc)}
function cF(a,b){var c,d;if(1==a.r[b])if(c=a.G[b],d=a.H[b],2>a.y[c]&&2>a.y[d])a.A[b]=0,rp(a.k,"Stereomarking meaningless on this bond !");else switch(a.A[b]){case 0:a.y[d]<=a.y[c]?a.A[b]=1:a.A[b]=3;break;case 1:a.A[b]=2;break;case 2:2<a.y[d]?a.A[b]=3:a.A[b]=1;break;case 3:a.A[b]=4;break;case 4:2<a.y[c]?a.A[b]=1:a.A[b]=3}else 2==a.r[b]?10==a.A[b]?a.A[b]=0:a.A[b]=10:rp(a.k,"Stereomarking allowed only on single and double bonds!")}
function DF(a,b,c,d,e){var f,g,h,i,l,m,n,o,q;if(!(2!=a.r[b]||5==a.f[b])&&(10==a.A[b]||a.k.o&&!e[b]))if(e=a.G[b],f=a.H[b],!(2>a.y[e]||2>a.y[f]||3<a.y[e]||3<a.y[f])){c[e]>c[f]&&(g=e,e=f,f=g);n=m=b=0;o=!1;for(l=1;l<=a.y[e];++l)g=a.F[e][l],g!=f&&(0==m?m=g:n=g);0<n&&c[m]>c[n]&&(g=m,m=n,n=g);i=qF(a,e,m);0!=d[i]?b=m:1==a.r[i]&&5!=a.f[i]&&(b=m);0==b&&(i=qF(a,e,n),0!=d[i]?b=n:1==a.r[i]&&5!=a.f[i]&&(b=n));c[b]>c[e]&&(o=!0);h=n=m=0;for(l=1;l<=a.y[f];++l)g=a.F[f][l],g!=e&&(0==n?n=g:h=g);0<h&&c[n]<c[h]&&(g=n,
n=h,h=g);i=qF(a,f,n);1==a.r[i]&&5!=a.f[i]&&0==d[i]&&(m=n);0==m&&(i=qF(a,f,h),1==a.r[i]&&5!=a.f[i]&&(m=h));if(!(0==b||0==m))if(i=a.I[f]-a.I[e],g=a.L[f]-a.L[e],l=Math.sqrt(i*i+g*g),0.001>l&&(l=0.001),g/=l,i/=l,n=(a.L[b]-a.L[e])*i-(a.I[b]-a.I[e])*g,q=(a.L[m]-a.L[e])*i-(a.I[m]-a.I[e])*g,2>(0>=n?0-n:n)||2>(0>=q?0-q:q))rp(a.k,"Not unique E/Z geometry !");else{h=qF(a,b,e);f=qF(a,m,f);m=1;if(0==d[h]){for(l=1;l<=a.y[b];++l)if(g=a.F[b][l],g!=e&&(i=qF(a,b,g),0!=d[i])){c[g]>c[b]?m=-d[i]:m=d[i];break}d[h]=m}0==
d[f]&&(0<n&&0<q||0>n&&0>q?d[f]=-d[h]:d[f]=d[h],o&&(d[f]=-d[f]))}}}function vF(a,b){var c,d,e;e=0;for(d=1;d<=a.y[b];++d)if(c=qF(a,b,a.F[b][d]),1==a.r[c])e+=1;else if(xF(a,c))e+=2;else if(3==a.r[c])e+=3;else if(9==a.r[c])return-1;return e}function EF(a,b,c){var d;d=a.A[b];return 1>d||4<d?0:1==d&&a.G[b]==c?1:2==d&&a.G[b]==c?-1:3==d&&a.H[b]==c?1:4==d&&a.H[b]==c?-1:0}
function sC(a){var b;for(b=1;b<=a.s;++b){var c=a,d=b,e=void 0,e=vF(c,d);if(-1==e)c.w[d]=0;else{switch(c.c[d]){case 1:2==e?c.z[d]=1:c.z[d]=0;c.w[d]=0;break;case 2:3==e||5==e?(c.w[d]=0,c.z[d]=0):3>e?c.w[d]=3-e-c.z[d]:4==e?(c.z[d]=-1,c.w[d]=0):5<e&&(c.z[d]=e-5,c.w[d]=0);break;case 3:case 6:4>e?0<c.z[d]?c.w[d]=2-e+c.z[d]:0>c.z[d]?c.w[d]=2-e-c.z[d]:c.w[d]=4-e:(c.z[d]=e-4,c.w[d]=4-e+c.z[d]);break;case 4:case 7:3>e?c.w[d]=3-e+c.z[d]:3==e?0>c.z[d]?(c.z[d]=0,c.w[d]=0):0<c.z[d]?c.w[d]=c.z[d]:c.w[d]=0:(c.z[d]=
4==e?1:6==e?-1:e-5,c.w[d]=0);break;case 5:2==e&&(0>c.z[d]?(c.z[d]=0,c.w[d]=0):0<c.z[d]?c.w[d]=c.z[d]:c.w[d]=0);2<e&&(c.z[d]=e-2);c.w[d]=2-e+c.z[d];break;case 8:case 13:2>e?c.w[d]=2-e+c.z[d]:2==e?0>c.z[d]?(c.z[d]=0,c.w[d]=0):0<c.z[d]?c.w[d]=c.z[d]:c.w[d]=0:3==e?2==c.y[d]?(c.z[d]=0,c.w[d]=1):(c.z[d]=1,c.w[d]=0):4==e?(c.z[d]=0,c.w[d]=0):5==e?(c.z[d]=0,c.w[d]=1):(c.z[d]=e-6,c.w[d]=0);break;case 9:case 10:case 11:case 12:1<=e&&(c.z[d]=e-1);c.w[d]=1-e+c.z[d];2<e&&(c.z[d]=0,c.w[d]=0);break;case 19:case 18:c.w[d]=
0}0>c.w[d]&&(c.w[d]=0)}}}function wE(a){nF(this);this.k=a;this.x=this.t=this.s=0}
function NE(a,b){var c,d,e,f,g,h,i;wE.call(this,a);f=j;h=LE(b);if(null!=h){i=new pA(b,h,!0);for(e=1;4>=e;++e)f=ME(i,h);g=rB(Xz(dn(f.substr(0,3)),10)).a;c=rB(Xz(dn(f.substr(3,3)),10)).a;for(e=1;e<=g;++e)dF(this),f=ME(i,h),this.I[e]=(new qB(nB(dn(f.substr(0,10))))).a,this.L[e]=-(new qB(nB(dn(f.substr(10,10))))).a,d=34,34>f.length&&(d=f.length),d=dn(f.substr(31,d-31)),VE(this,e,d),62<=f.length&&(f=dn(f.substr(60,3)),0<f.length&&(f=rB(Xz(f,10)).a,0<f&&(this.C=e,a.u=f,bF(this),this.C=0)));for(e=1;e<=c;++e)pC(this),
f=ME(i,h),this.G[e]=rB(Xz(dn(f.substr(0,3)),10)).a,this.H[e]=rB(Xz(dn(f.substr(3,3)),10)).a,g=rB(Xz(dn(f.substr(6,3)),10)).a,1==g?this.r[e]=1:2==g?this.r[e]=2:3==g?this.r[e]=3:this.r[e]=9,d=0,11<f.length&&(d=rB(Xz(dn(f.substr(9,3)),10)).a),1==g&&1==d&&(this.r[e]=1,this.A[e]=1),1==g&&6==d&&(this.r[e]=1,this.A[e]=2);wF(this);eF(this);uE(this);for(TA(this);(i.j=jA(i,i.a),i.j<i.i)&&!(null==(f=mA(i)));){if(0==f.indexOf("M  END"))break;if(0==f.indexOf("M  CHG")){g=new oA(f);mA(g);mA(g);h=rB(Xz(mA(g),10)).a;
for(e=1;e<=h;++e)c=rB(Xz(mA(g),10)).a,this.z[c]=rB(Xz(mA(g),10)).a}if(0==f.indexOf("M  APO")){g=new oA(f);mA(g);mA(g);h=rB(Xz(mA(g),10)).a;for(e=1;e<=h;++e)c=rB(Xz(mA(g),10)).a,f=rB(Xz(mA(g),10)).a,this.C=c,X(this,0),VE(this,this.s,uc+f),this.C=0}}zF(this);TA(this)}}
function SA(a,b){var c,d,e,f,g;wE.call(this,a);0==b.indexOf(fa)&&(b=b.substr(1,b.length-1));wB(b,fa)&&(b=b.substr(0,b.length-1-0));if(1>b.length)this.s=0;else{try{f=new oA(b);d=rB(Xz(mA(f),10)).a;e=rB(Xz(mA(f),10)).a;for(c=1;c<=d;++c)g=mA(f),dF(this),VE(this,this.s,g),this.I[c]=(new qB(nB(mA(f)))).a,this.L[c]=-(new qB(nB(mA(f)))).a;for(c=1;c<=e;++c)if(pC(this),this.G[c]=rB(Xz(mA(f),10)).a,this.H[c]=rB(Xz(mA(f),10)).a,this.r[c]=rB(Xz(mA(f),10)).a,-1==this.r[c])this.r[c]=1,this.A[c]=1;else if(-2==this.r[c])this.r[c]=
1,this.A[c]=2;else if(-5==this.r[c])this.r[c]=2,this.A[c]=10;else if(11==this.r[c]||12==this.r[c]||13==this.r[c]||14==this.r[c])this.A[c]=this.r[c],this.r[c]=9;wF(this);eF(this);uE(this)}catch(h){h=Xh(h);if(y(h,67)){h.mc();this.s=0;return}throw h;}zF(this);TA(this)}}
function PE(a,b,c){var d,e,f;wE.call(this,a);f=v(F,r,-1,b.s+1,1);for(a=1;a<=b.s;++a)b.a[a]==c&&(dF(this),this.c[this.s]=b.c[a],this.I[this.s]=b.I[a],this.L[this.s]=b.L[a],this.z[this.s]=b.z[a],this.w[this.s]=b.w[a],this.b[this.s]=b.b[a],this.d[this.s]=b.d[a],this.n[this.s]=b.n[a],f[a]=this.s);for(a=1;a<=b.t;++a)if(d=b.G[a],e=b.H[a],!(b.a[d]!=c&&b.a[e]!=c)&&!(b.a[d]!=c||b.a[e]!=c))pC(this),this.r[this.t]=b.r[a],this.A[this.t]=b.A[a],this.G[this.t]=f[d],this.H[this.t]=f[e],this.e[this.t]=b.e[a];for(a=
1;a<=b.x;++a)d=b.p[a][0],d==c&&(++this.x,this.p[this.x][0]=f[d],this.p[this.x][1]=b.p[a][1]);this.j=b.j;TA(this);uE(this)}
function YE(a,b,c){var d,e,f,g,h;wE.call(this,a);for(a=1;a<=c;++a)this.s+=b[a].s,this.t+=b[a].t,this.x+=b[a].x;this.c=v(F,r,-1,this.s+1,1);this.z=v(F,r,-1,this.s+1,1);this.w=v(F,r,-1,this.s+1,1);this.b=v(F,r,-1,this.s+1,1);this.d=v(Fq,k,1,this.s+1,0);this.I=v(mC,k,-1,this.s+1,1);this.L=v(mC,k,-1,this.s+1,1);this.n=v(Fq,k,1,this.s+1,0);this.G=v(F,r,-1,this.t+1,1);this.H=v(F,r,-1,this.t+1,1);this.r=v(F,r,-1,this.t+1,1);this.e=v(Fq,k,1,this.t+1,0);this.A=v(F,r,-1,this.t+1,1);this.p=uq([this.x+1,2]);
f=h=g=e=0;for(a=1;a<=c;++a){for(d=1;d<=b[a].s;++d)++e,this.c[e]=b[a].c[d],this.I[e]=b[a].I[d],this.L[e]=b[a].L[d],this.z[e]=b[a].z[d],this.w[e]=b[a].w[d],this.b[e]=b[a].b[d],this.d[e]=b[a].d[d],this.n[e]=b[a].n[d];for(d=1;d<=b[a].t;++d)++g,this.r[g]=b[a].r[d],this.A[g]=b[a].A[d],this.G[g]=b[a].G[d]+f,this.H[g]=b[a].H[d]+f,this.e[g]=b[a].e[d];for(d=1;d<=b[a].x;++d)++h,this.p[h][0]=b[a].p[d][0]+f,this.p[h][1]=b[a].p[d][1];f=e}TA(this);uE(this)}
function sE(a){var b;nF(this);this.k=a.k;this.s=a.s;this.t=a.t;this.x=a.x;this.c=v(F,r,-1,this.s+1,1);EB(a.c,this.c,this.s+1);this.z=v(F,r,-1,this.s+1,1);EB(a.z,this.z,this.s+1);this.w=v(F,r,-1,this.s+1,1);EB(a.w,this.w,this.s+1);this.b=v(F,r,-1,this.s+1,1);EB(a.b,this.b,this.s+1);this.d=v(Fq,k,1,this.s+1,0);EB(a.d,this.d,this.s+1);this.I=v(mC,k,-1,this.s+1,1);EB(a.I,this.I,this.s+1);this.L=v(mC,k,-1,this.s+1,1);EB(a.L,this.L,this.s+1);this.n=v(Fq,k,1,this.s+1,0);EB(a.n,this.n,this.s+1);this.G=v(F,
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